4-[[5-methyl-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[5-methyl-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[4-(4-isopropylphenyl)-5-methyl-thiazol-2-yl]amino]-4-oxo-butanoate CAS Name: 4-[[5-methyl-4-(4-propan-2-ylphenyl)-2-thiazolyl]amino]-4-oxobutanoate IUPAC Name: 4-[[5-methyl-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]amino]-4-oxobutanoate Traditional Name: 4-keto-4-[(5-methyl-4-p-cumenyl-thiazol-2-yl)amino]butyrate Formula: C17H19N2O3S- MolecularWeight: 331.40936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O3S/c1-10(2)12-4-6-13(7-5-12)16-11(3)23-17(19-16)18-14(20)8-9-15(21)22/h4-7,10H,8-9H2,1-3H3,(H,21,22)(H,18,19,20)/p-1