ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate

C82H77N23O22S8 — CID 159373528

About ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate

ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate (PubChem CID 159373528) has the molecular formula C82H77N23O22S8 and a molecular weight of 1993.19 g/mol. Its IUPAC name is ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate.

Molecular Properties

• Compound Name: ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate
• PubChem CID: 159373528
• Molecular Formula: C82H77N23O22S8
• Molecular Weight: 1993.19 g/mol
• Exact Mass: 1991.34
• IUPAC Name: ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate
• SMILES: CCOC(=O)NC(=O)c1ccsc1NC(=O)c1cc2ncccn2n1.CCOC(=O)NC(=O)c1ccsc1NC(=O)c1cccnn1.CCOC(=O)NC(=O)c1ccsc1NC(=O)c1nc2c(C)nccc2s1.CCOC(=O)NC(=O)c1ccsc1NC(=O)c1nc2c(N3CCOCC3)ccnc2s1.CCOC(=O)NC(=O)c1ccsc1NC(=O)c1nc2c(N3CCOCC3)nccc2s1
• InChI: InChI=1S/2C19H19N5O5S2.C16H14N4O4S2.C15H13N5O4S.C13H12N4O4S/c1-2-29-19(27)23-15(25)11-4-10-30-17(11)22-16(26)18-21-13-12(31-18)3-5-20-14(13)24-6-8-28-9-7-24;1-2-29-19(27)23-14(25)11-4-10-30-16(11)22-15(26)18-21-13-12(3-5-20-17(13)31-18)24-6-8-28-9-7-24;1-3-24-16(23)20-12(21)9-5-7-25-14(9)19-13(22)15-18-11-8(2)17-6-4-10(11)26-15;1-2-24-15(23)18-12(21)9-4-7-25-14(9)17-13(22)10-8-11-16-5-3-6-20(11)19-10;1-2-21-13(20)16-10(18)8-5-7-22-12(8)15-11(19)9-4-3-6-14-17-9/h2*3-5,10H,2,6-9H2,1H3,(H,22,26)(H,23,25,27);4-7H,3H2,1-2H3,(H,19,22)(H,20,21,23);3-8H,2H2,1H3,(H,17,22)(H,18,21,23);3-7H,2H2,1H3,(H,15,19)(H,16,18,20)
• InChIKey: LKALDEOYNLRGDT-UHFFFAOYSA-N
• XLogP: 12.26
• TPSA: 580.75 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 43
• Rotatable Bonds: 22
• Heavy Atoms: 135
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1993.19
LogP ≤ 5	12.26
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	43

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate?

The IUPAC name of ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate (CID 159373528) is ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate.

What is the SMILES notation for ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate?

The canonical SMILES for ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate is CCOC(=O)NC(=O)c1ccsc1NC(=O)c1cc2ncccn2n1.CCOC(=O)NC(=O)c1ccsc1NC(=O)c1cccnn1.CCOC(=O)NC(=O)c1ccsc1NC(=O)c1nc2c(C)nccc2s1.CCOC(=O)NC(=O)c1ccsc1NC(=O)c1nc2c(N3CCOCC3)ccnc2s1.CCOC(=O)NC(=O)c1ccsc1NC(=O)c1nc2c(N3CCOCC3)nccc2s1.

What is the InChIKey of ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate?

The InChIKey is LKALDEOYNLRGDT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H19N5O5S2.C16H14N4O4S2.C15H13N5O4S.C13H12N4O4S/c1-2-29-19(27)23-15(25)11-4-10-30-17(11)22-16(26)18-21-13-12(31-18)3-5-20-14(13)24-6-8-28-9-7-24;1-2-29-19(27)23-14(25)11-4-10-30-16(11)22-15(26)18-21-13-12(3-5-20-17(13)31-18)24-6-8-28-9-7-24;1-3-24-16(23)20-12(21)9-5-7-25-14(9)19-13(22)15-18-11-8(2)17-6-4-10(11)26-15;1-2-24-15(23)18-12(21)9-4-7-25-14(9)17-13(22)10-8-11-16-5-3-6-20(11)19-10;1-2-21-13(20)16-10(18)8-5-7-22-12(8)15-11(19)9-4-3-6-14-17-9/h2*3-5,10H,2,6-9H2,1H3,(H,22,26)(H,23,25,27);4-7H,3H2,1-2H3,(H,19,22)(H,20,21,23);3-8H,2H2,1H3,(H,17,22)(H,18,21,23);3-7H,2H2,1H3,(H,15,19)(H,16,18,20).

What are the key properties of ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate?

ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate has a molecular weight of 1993.19 g/mol, XLogP of 12.26, 22 rotatable bonds, 10 hydrogen bond donors, and 43 hydrogen bond acceptors.

Where does this data come from?

All data for ethyl N-[2-[(4-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(7-morpholin-4-yl-[1,3]thiazolo[5,4-b]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-[(4-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)thiophene-3-carbonyl]carbamate;ethyl N-[2-(pyridazine-3-carbonylamino)thiophene-3-carbonyl]carbamate is sourced from PubChem (CID 159373528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).