4-[[4-[(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)amino]phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-[(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)amino]phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[(5-ethoxycarbonyl-4-methyl-thiazol-2-yl)amino]anilino]-4-oxo-butanoic acid CAS Name: 4-[4-[(5-ethoxycarbonyl-4-methyl-2-thiazolyl)amino]anilino]-4-oxobutanoic acid IUPAC Name: 4-[4-[(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)amino]anilino]-4-oxobutanoic acid Traditional Name: 4-[4-[(5-carbethoxy-4-methyl-thiazol-2-yl)amino]anilino]-4-keto-butyric acid Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC2=CC=C(C=C2)NC(=O)CCC(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC2=CC=C(C=C2)NC(=O)CCC(=O)O)C

InChI

InChI=1S/C17H19N3O5S/c1-3-25-16(24)15-10(2)18-17(26-15)20-12-6-4-11(5-7-12)19-13(21)8-9-14(22)23/h4-7H,3,8-9H2,1-2H3,(H,18,20)(H,19,21)(H,22,23)