About N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide
N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide (PubChem CID 157116851) has the molecular formula C117H102Cl5N17O13S2
and a molecular weight of 2195.61 g/mol. Its IUPAC name is N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide.
Analyze N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide with MolForge
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Frequently Asked Questions
What is the IUPAC name of N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide?
The IUPAC name of N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide (CID 157116851) is N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide?
The canonical SMILES for N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide is Cc1cnc(C)c(C(=O)N[C@@H](C)c2cc3cccc(Cl)c3c(=O)n2-c2ccccc2)n1.Cc1ncc(-c2ccc(OC(C)C)c(Cl)c2)nc1C(=O)N[C@@H](C)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1.Cc1ncc(-c2ccc(S(C)(=O)=O)cc2)nc1C(=O)N[C@@H](C)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1.Cc1ncc(-c2cccc(S(=O)(=O)N(C)C)c2)nc1C(=O)N[C@@H](C)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1.
What is the InChIKey of N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide?
The InChIKey is AHMUOXNTUUQWQK-KLRCDSKESA-N. The full InChI is InChI=1S/C32H28Cl2N4O3.C31H28ClN5O4S.C30H25ClN4O4S.C24H21ClN4O2/c1-18(2)41-28-14-13-21(15-25(28)34)26-17-35-20(4)30(37-26)31(39)36-19(3)27-16-22-9-8-12-24(33)29(22)32(40)38(27)23-10-6-5-7-11-23;1-19(27-17-22-11-9-15-25(32)28(22)31(39)37(27)23-12-6-5-7-13-23)34-30(38)29-20(2)33-18-26(35-29)21-10-8-14-24(16-21)42(40,41)36(3)4;1-18(26-16-21-8-7-11-24(31)27(21)30(37)35(26)22-9-5-4-6-10-22)33-29(36)28-19(2)32-17-25(34-28)20-12-14-23(15-13-20)40(3,38)39;1-14-13-26-16(3)22(27-14)23(30)28-15(2)20-12-17-8-7-11-19(25)21(17)24(31)29(20)18-9-5-4-6-10-18/h5-19H,1-4H3,(H,36,39);5-19H,1-4H3,(H,34,38);4-18H,1-3H3,(H,33,36);4-13,15H,1-3H3,(H,28,30)/t2*19-;18-;15-/m0000/s1.
What are the key properties of N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide?
N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide has a molecular weight of 2195.61 g/mol, XLogP of 22.34, 24 rotatable bonds, 4 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-(3-chloro-4-propan-2-yloxyphenyl)-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3,6-dimethylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-6-[3-(dimethylsulfamoyl)phenyl]-3-methylpyrazine-2-carboxamide;N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-3-methyl-6-(4-methylsulfonylphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 157116851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).