3-[[2-[(3-methylphenyl)carbonylamino]-1,3-thiazol-4-yl]carbonylamino]propanoate

Systemtic Name: 3-[[2-[(3-methylphenyl)carbonylamino]-1,3-thiazol-4-yl]carbonylamino]propanoate Openeye Name: 3-[[2-[(3-methylbenzoyl)amino]thiazole-4-carbonyl]amino]propanoate CAS Name: 3-[[[2-[[(3-methylphenyl)-oxomethyl]amino]-4-thiazolyl]-oxomethyl]amino]propanoate IUPAC Name: 3-[[2-[(3-methylbenzoyl)amino]-1,3-thiazole-4-carbonyl]amino]propanoate Traditional Name: 3-[[2-(m-toluoylamino)thiazole-4-carbonyl]amino]propionate Formula: C15H14N3O4S- MolecularWeight: 332.35436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=NC(=CS2)C(=O)NCCC(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=NC(=CS2)C(=O)NCCC(=O)[O-]

InChI

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