[[2-[(2-carboxy-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-(4-oxidanylidene-1,3-thiazol-2-yl)amino]-propan-2-ylidene-azanium

Systemtic Name: [[2-[(2-carboxy-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-(4-oxidanylidene-1,3-thiazol-2-yl)amino]-propan-2-ylidene-azanium Openeye Name: [[2-(2-carboxy-4-methyl-anilino)-2-oxo-ethyl]-(4-oxothiazol-2-yl)amino]-isopropylidene-ammonium CAS Name: [[2-(2-carboxy-4-methylanilino)-2-oxoethyl]-(4-oxo-2-thiazolyl)amino]-propan-2-ylideneammonium IUPAC Name: [[2-(2-carboxy-4-methylanilino)-2-oxoethyl]-(4-oxo-1,3-thiazol-2-yl)amino]-propan-2-ylideneazanium Traditional Name: [[2-(2-carboxy-4-methyl-anilino)-2-keto-ethyl]-(4-keto-2-thiazolin-2-yl)amino]-isopropylidene-ammonium Formula: C16H19N4O4S+ MolecularWeight: 363.41146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CN(C2=NC(=O)CS2)[NH+]=C(C)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CN(C2=NC(=O)CS2)[NH+]=C(C)C)C(=O)O

InChI

InChI=1S/C16H18N4O4S/c1-9(2)19-20(16-18-14(22)8-25-16)7-13(21)17-12-5-4-10(3)6-11(12)15(23)24/h4-6H,7-8H2,1-3H3,(H,17,21)(H,23,24)/p+1