propan-2-yl 4-cyano-3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2-carboxylate

Systemtic Name: propan-2-yl 4-cyano-3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2-carboxylate Openeye Name: isopropyl 4-cyano-3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-cyano-3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[[(E)-3-(3-nitrophenyl)acryloyl]amino]thiophene-2-carboxylic acid isopropyl ester Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C19H17N3O5S/c1-11(2)27-19(24)17-12(3)15(10-20)18(28-17)21-16(23)8-7-13-5-4-6-14(9-13)22(25)26/h4-9,11H,1-3H3,(H,21,23)/b8-7+