ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-[5-(3-nitrophenyl)-2-furyl]prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[[2-cyano-3-[5-(3-nitrophenyl)-2-furanyl]-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-[[2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[[2-cyano-3-[5-(3-nitrophenyl)-2-furyl]acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C27H18ClN3O6S MolecularWeight: 547.96632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])C#N

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C27H18ClN3O6S/c1-2-36-27(33)24-22(16-6-8-19(28)9-7-16)15-38-26(24)30-25(32)18(14-29)13-21-10-11-23(37-21)17-4-3-5-20(12-17)31(34)35/h3-13,15H,2H2,1H3,(H,30,32)