propan-2-yl 2-[(3-azanyl-6-butyl-thieno[2,3-b]pyridin-2-yl)carbonylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[(3-azanyl-6-butyl-thieno[2,3-b]pyridin-2-yl)carbonylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylate Openeye Name: isopropyl 2-[(3-amino-6-butyl-thieno[2,3-b]pyridine-2-carbonyl)amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[(3-amino-6-butyl-2-thieno[2,3-b]pyridinyl)-oxomethyl]amino]-4-(4-methoxyphenyl)-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(3-amino-6-butylthieno[2,3-b]pyridine-2-carbonyl)amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[(3-amino-6-butyl-thieno[2,3-b]pyridine-2-carbonyl)amino]-4-(4-methoxyphenyl)thiophene-3-carboxylic acid isopropyl ester Formula: C27H29N3O4S2 MolecularWeight: 523.66686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)OC)C(=O)OC(C)C)N

Isomeric SMILES

CCCCC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)OC)C(=O)OC(C)C)N

InChI

InChI=1S/C27H29N3O4S2/c1-5-6-7-17-10-13-19-22(28)23(36-25(19)29-17)24(31)30-26-21(27(32)34-15(2)3)20(14-35-26)16-8-11-18(33-4)12-9-16/h8-15H,5-7,28H2,1-4H3,(H,30,31)