7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one

C168H203Cl5N12O20S — CID 159024200

About 7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one

7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one (PubChem CID 159024200) has the molecular formula C168H203Cl5N12O20S and a molecular weight of 2919.87 g/mol. Its IUPAC name is 7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one.

Molecular Properties

• Compound Name: 7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one
• PubChem CID: 159024200
• Molecular Formula: C168H203Cl5N12O20S
• Molecular Weight: 2919.87 g/mol
• Exact Mass: 2915.34
• IUPAC Name: 7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one
• SMILES: CC[C@@H](C)Oc1cc2c(cc1OC)CC(=O)N(c1ccc(C(C)N3CCCC3)cc1)C2c1ccc(Cl)cc1.CC[C@@H](C)Oc1cc2c(cc1OC)CC(=O)N(c1ccc(C(C)N3CCOCC3)cc1)C2c1ccc(Cl)cc1.CC[C@@H](C)Oc1cc2c(cc1OC)CC(=O)N(c1ccc(C(C)O)cc1)C2c1ccc(Cl)cc1.CC[C@@H](C)Oc1cc2c(cc1OC)CC(=O)N(c1ccc(N(C)CC3CCC(N(CC)C(=O)N(C)C)CC3)cc1)C2c1ccc(Cl)cc1.CC[C@@H](C)Oc1cc2c(cc1OC)CC(=O)N(c1ccc(N(C)CC3CCC(N(CC)S(C)(=O)=O)CC3)cc1)C2c1ccc(Cl)cc1
• InChI: InChI=1S/C39H51ClN4O4.C37H48ClN3O5S.C32H37ClN2O4.C32H37ClN2O3.C28H30ClNO4/c1-8-26(3)48-36-24-34-29(22-35(36)47-7)23-37(45)44(38(34)28-12-14-30(40)15-13-28)33-20-18-31(19-21-33)42(6)25-27-10-16-32(17-11-27)43(9-2)39(46)41(4)5;1-7-25(3)46-35-23-33-28(21-34(35)45-5)22-36(42)41(37(33)27-11-13-29(38)14-12-27)32-19-17-30(18-20-32)39(4)24-26-9-15-31(16-10-26)40(8-2)47(6,43)44;1-5-21(2)39-30-20-28-25(18-29(30)37-4)19-31(36)35(32(28)24-6-10-26(33)11-7-24)27-12-8-23(9-13-27)22(3)34-14-16-38-17-15-34;1-5-21(2)38-30-20-28-25(18-29(30)37-4)19-31(36)35(32(28)24-8-12-26(33)13-9-24)27-14-10-23(11-15-27)22(3)34-16-6-7-17-34;1-5-17(2)34-26-16-24-21(14-25(26)33-4)15-27(32)30(23-12-8-19(9-13-23)18(3)31)28(24)20-6-10-22(29)11-7-20/h12-15,18-22,24,26-27,32,38H,8-11,16-17,23,25H2,1-7H3;11-14,17-21,23,25-26,31,37H,7-10,15-16,22,24H2,1-6H3;6-13,18,20-22,32H,5,14-17,19H2,1-4H3;8-15,18,20-22,32H,5-7,16-17,19H2,1-4H3;6-14,16-18,28,31H,5,15H2,1-4H3/t26-,27?,32?,38?;25-,26?,31?,37?;2*21-,22?,32?;17-,18?,28?/m11111/s1
• InChIKey: JUBWLQOIRPGSJM-QNTBCBOESA-N
• XLogP: 35.90
• TPSA: 297.20 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 24
• Rotatable Bonds: 46
• Heavy Atoms: 206
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2919.87
LogP ≤ 5	35.90
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one?

The IUPAC name of 7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one (CID 159024200) is 7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one.

What is the SMILES notation for 7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one?

The canonical SMILES for 7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one is CC[C@@H](C)Oc1cc2c(cc1OC)CC(=O)N(c1ccc(C(C)N3CCCC3)cc1)C2c1ccc(Cl)cc1.CC[C@@H](C)Oc1cc2c(cc1OC)CC(=O)N(c1ccc(C(C)N3CCOCC3)cc1)C2c1ccc(Cl)cc1.CC[C@@H](C)Oc1cc2c(cc1OC)CC(=O)N(c1ccc(C(C)O)cc1)C2c1ccc(Cl)cc1.CC[C@@H](C)Oc1cc2c(cc1OC)CC(=O)N(c1ccc(N(C)CC3CCC(N(CC)C(=O)N(C)C)CC3)cc1)C2c1ccc(Cl)cc1.CC[C@@H](C)Oc1cc2c(cc1OC)CC(=O)N(c1ccc(N(C)CC3CCC(N(CC)S(C)(=O)=O)CC3)cc1)C2c1ccc(Cl)cc1.

What is the InChIKey of 7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one?

The InChIKey is JUBWLQOIRPGSJM-QNTBCBOESA-N. The full InChI is InChI=1S/C39H51ClN4O4.C37H48ClN3O5S.C32H37ClN2O4.C32H37ClN2O3.C28H30ClNO4/c1-8-26(3)48-36-24-34-29(22-35(36)47-7)23-37(45)44(38(34)28-12-14-30(40)15-13-28)33-20-18-31(19-21-33)42(6)25-27-10-16-32(17-11-27)43(9-2)39(46)41(4)5;1-7-25(3)46-35-23-33-28(21-34(35)45-5)22-36(42)41(37(33)27-11-13-29(38)14-12-27)32-19-17-30(18-20-32)39(4)24-26-9-15-31(16-10-26)40(8-2)47(6,43)44;1-5-21(2)39-30-20-28-25(18-29(30)37-4)19-31(36)35(32(28)24-6-10-26(33)11-7-24)27-12-8-23(9-13-27)22(3)34-14-16-38-17-15-34;1-5-21(2)38-30-20-28-25(18-29(30)37-4)19-31(36)35(32(28)24-8-12-26(33)13-9-24)27-14-10-23(11-15-27)22(3)34-16-6-7-17-34;1-5-17(2)34-26-16-24-21(14-25(26)33-4)15-27(32)30(23-12-8-19(9-13-23)18(3)31)28(24)20-6-10-22(29)11-7-20/h12-15,18-22,24,26-27,32,38H,8-11,16-17,23,25H2,1-7H3;11-14,17-21,23,25-26,31,37H,7-10,15-16,22,24H2,1-6H3;6-13,18,20-22,32H,5,14-17,19H2,1-4H3;8-15,18,20-22,32H,5-7,16-17,19H2,1-4H3;6-14,16-18,28,31H,5,15H2,1-4H3/t26-,27?,32?,38?;25-,26?,31?,37?;2*21-,22?,32?;17-,18?,28?/m11111/s1.

What are the key properties of 7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one?

7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one has a molecular weight of 2919.87 g/mol, XLogP of 35.90, 46 rotatable bonds, 1 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-2-[4-(1-hydroxyethyl)phenyl]-6-methoxy-1,4-dihydroisoquinolin-3-one;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-morpholin-4-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one;1-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-1-ethyl-3,3-dimethylurea;N-[4-[[4-[7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-3-oxo-1,4-dihydroisoquinolin-2-yl]-N-methylanilino]methyl]cyclohexyl]-N-ethylmethanesulfonamide;7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]-1,4-dihydroisoquinolin-3-one is sourced from PubChem (CID 159024200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).