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

Systemtic Name: ethyl 2-[[6-[(3-ethoxycarbonyl-1-benzothiophen-2-yl)carbamoyl]pyridin-3-yl]carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[6-[(3-ethoxycarbonylbenzothiophen-2-yl)carbamoyl]pyridine-3-carbonyl]amino]benzothiophene-3-carboxylate CAS Name: 2-[[[6-[[(3-ethoxycarbonyl-1-benzothiophen-2-yl)amino]-oxomethyl]-3-pyridinyl]-oxomethyl]amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[6-[(3-ethoxycarbonyl-1-benzothiophen-2-yl)carbamoyl]pyridine-3-carbonyl]amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[[6-[(3-carbethoxybenzothiophen-2-yl)carbamoyl]nicotinoyl]amino]benzothiophene-3-carboxylic acid ethyl ester Formula: C29H23N3O6S2 MolecularWeight: 573.63942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=CN=C(C=C3)C(=O)NC4=C(C5=CC=CC=C5S4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=CN=C(C=C3)C(=O)NC4=C(C5=CC=CC=C5S4)C(=O)OCC

InChI

InChI=1S/C29H23N3O6S2/c1-3-37-28(35)22-17-9-5-7-11-20(17)39-26(22)31-24(33)16-13-14-19(30-15-16)25(34)32-27-23(29(36)38-4-2)18-10-6-8-12-21(18)40-27/h5-15H,3-4H2,1-2H3,(H,31,33)(H,32,34)