methyl 3-[[(Z)-2-cyano-3-(4-cyanophenyl)prop-2-enoyl]amino]-4-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-[[(Z)-2-cyano-3-(4-cyanophenyl)prop-2-enoyl]amino]-4-methyl-thiophene-2-carboxylate Openeye Name: methyl 3-[[(Z)-2-cyano-3-(4-cyanophenyl)prop-2-enoyl]amino]-4-methyl-thiophene-2-carboxylate CAS Name: 3-[[(Z)-2-cyano-3-(4-cyanophenyl)-1-oxoprop-2-enyl]amino]-4-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[(Z)-2-cyano-3-(4-cyanophenyl)prop-2-enoyl]amino]-4-methylthiophene-2-carboxylate Traditional Name: 3-[[(Z)-2-cyano-3-(4-cyanophenyl)acryloyl]amino]-4-methyl-thiophene-2-carboxylic acid methyl ester Formula: C18H13N3O3S MolecularWeight: 351.37912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1NC(=O)C(=CC2=CC=C(C=C2)C#N)C#N)C(=O)OC

Isomeric SMILES

CC1=CSC(=C1NC(=O)/C(=C\C2=CC=C(C=C2)C#N)/C#N)C(=O)OC

InChI

InChI=1S/C18H13N3O3S/c1-11-10-25-16(18(23)24-2)15(11)21-17(22)14(9-20)7-12-3-5-13(8-19)6-4-12/h3-7,10H,1-2H3,(H,21,22)/b14-7-