butyl 2-[[6-[(3-butoxycarbonyl-1-benzothiophen-2-yl)carbamoyl]pyridin-3-yl]carbonylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: butyl 2-[[6-[(3-butoxycarbonyl-1-benzothiophen-2-yl)carbamoyl]pyridin-3-yl]carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: butyl 2-[[6-[(3-butoxycarbonylbenzothiophen-2-yl)carbamoyl]pyridine-3-carbonyl]amino]benzothiophene-3-carboxylate CAS Name: 2-[[[6-[[[3-[butoxy(oxo)methyl]-1-benzothiophen-2-yl]amino]-oxomethyl]-3-pyridinyl]-oxomethyl]amino]-1-benzothiophene-3-carboxylic acid butyl ester IUPAC Name: butyl 2-[[6-[(3-butoxycarbonyl-1-benzothiophen-2-yl)carbamoyl]pyridine-3-carbonyl]amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[[6-[(3-butoxycarbonylbenzothiophen-2-yl)carbamoyl]nicotinoyl]amino]benzothiophene-3-carboxylic acid butyl ester Formula: C33H31N3O6S2 MolecularWeight: 629.74574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=CN=C(C=C3)C(=O)NC4=C(C5=CC=CC=C5S4)C(=O)OCCCC

Isomeric SMILES

CCCCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=CN=C(C=C3)C(=O)NC4=C(C5=CC=CC=C5S4)C(=O)OCCCC

InChI

InChI=1S/C33H31N3O6S2/c1-3-5-17-41-32(39)26-21-11-7-9-13-24(21)43-30(26)35-28(37)20-15-16-23(34-19-20)29(38)36-31-27(33(40)42-18-6-4-2)22-12-8-10-14-25(22)44-31/h7-16,19H,3-6,17-18H2,1-2H3,(H,35,37)(H,36,38)