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

Systemtic Name: methyl 5-aminocarbonyl-2-[[(E)-2-cyano-3-thiophen-3-yl-prop-2-enoyl]amino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-carbamoyl-2-[[(E)-2-cyano-3-(3-thienyl)prop-2-enoyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-carbamoyl-2-[[(E)-2-cyano-1-oxo-3-(3-thiophenyl)prop-2-enyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-carbamoyl-2-[[(E)-2-cyano-3-thiophen-3-ylprop-2-enoyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-[[(E)-2-cyano-3-(3-thienyl)acryloyl]amino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C16H13N3O4S2 MolecularWeight: 375.42212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C(=CC2=CSC=C2)C#N)C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)/C(=C/C2=CSC=C2)/C#N)C(=O)N

InChI

InChI=1S/C16H13N3O4S2/c1-8-11(16(22)23-2)15(25-12(8)13(18)20)19-14(21)10(6-17)5-9-3-4-24-7-9/h3-5,7H,1-2H3,(H2,18,20)(H,19,21)/b10-5+