3-[[4-[(4-methyl-1,3-thiazol-2-yl)amino]-4-oxidanylidene-butanoyl]amino]benzoic acid

Systemtic Name: 3-[[4-[(4-methyl-1,3-thiazol-2-yl)amino]-4-oxidanylidene-butanoyl]amino]benzoic acid Openeye Name: 3-[[4-[(4-methylthiazol-2-yl)amino]-4-oxo-butanoyl]amino]benzoic acid CAS Name: 3-[[4-[(4-methyl-2-thiazolyl)amino]-1,4-dioxobutyl]amino]benzoic acid IUPAC Name: 3-[[4-[(4-methyl-1,3-thiazol-2-yl)amino]-4-oxobutanoyl]amino]benzoic acid Traditional Name: 3-[[4-keto-4-[(4-methylthiazol-2-yl)amino]butanoyl]amino]benzoic acid Formula: C15H15N3O4S MolecularWeight: 333.3623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CCC(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CCC(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C15H15N3O4S/c1-9-8-23-15(16-9)18-13(20)6-5-12(19)17-11-4-2-3-10(7-11)14(21)22/h2-4,7-8H,5-6H2,1H3,(H,17,19)(H,21,22)(H,16,18,20)