(3S)-5-[[3-cyano-4-(4-methoxyphenyl)-5-methyl-thiophen-2-yl]amino]-3-methyl-5-oxidanylidene-pentanoate

Systemtic Name: (3S)-5-[[3-cyano-4-(4-methoxyphenyl)-5-methyl-thiophen-2-yl]amino]-3-methyl-5-oxidanylidene-pentanoate Openeye Name: (3S)-5-[[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thienyl]amino]-3-methyl-5-oxo-pentanoate CAS Name: (3S)-5-[[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thiophenyl]amino]-3-methyl-5-oxopentanoate IUPAC Name: (3S)-5-[[3-cyano-4-(4-methoxyphenyl)-5-methylthiophen-2-yl]amino]-3-methyl-5-oxopentanoate Traditional Name: (3S)-5-[[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thienyl]amino]-5-keto-3-methyl-valerate Formula: C19H19N2O4S- MolecularWeight: 371.43016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CC(C)CC(=O)[O-])C#N)C2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C[C@H](C)CC(=O)[O-])C#N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C19H20N2O4S/c1-11(9-17(23)24)8-16(22)21-19-15(10-20)18(12(2)26-19)13-4-6-14(25-3)7-5-13/h4-7,11H,8-9H2,1-3H3,(H,21,22)(H,23,24)/p-1/t11-/m0/s1