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

Systemtic Name: 4-[[4-(2-azanylidene-5-ethoxycarbonyl-4-methyl-1,3-thiazol-3-yl)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[4-(5-ethoxycarbonyl-2-imino-4-methyl-thiazol-3-yl)anilino]-4-oxo-butanoate CAS Name: 4-[4-(5-ethoxycarbonyl-2-imino-4-methyl-3-thiazolyl)anilino]-4-oxobutanoate IUPAC Name: 4-[4-(5-ethoxycarbonyl-2-imino-4-methyl-1,3-thiazol-3-yl)anilino]-4-oxobutanoate Traditional Name: 4-[4-(5-carbethoxy-2-imino-4-methyl-4-thiazolin-3-yl)anilino]-4-keto-butyrate Formula: C17H18N3O5S- MolecularWeight: 376.40692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=N)S1)C2=CC=C(C=C2)NC(=O)CCC(=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=N)S1)C2=CC=C(C=C2)NC(=O)CCC(=O)[O-])C

InChI

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