2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylquinazoline-4-carboxylic acid

Systemtic Name: 2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylquinazoline-4-carboxylic acid Openeye Name: 2-[2-(2-methylanilino)-2-oxo-ethyl]sulfanylquinazoline-4-carboxylic acid CAS Name: 2-[[2-(2-methylanilino)-2-oxoethyl]thio]-4-quinazolinecarboxylic acid IUPAC Name: 2-[2-(2-methylanilino)-2-oxoethyl]sulfanylquinazoline-4-carboxylic acid Traditional Name: 2-[[2-keto-2-(o-toluidino)ethyl]thio]quinazoline-4-carboxylic acid Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=N2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=N2)C(=O)O

InChI

InChI=1S/C18H15N3O3S/c1-11-6-2-4-8-13(11)19-15(22)10-25-18-20-14-9-5-3-7-12(14)16(21-18)17(23)24/h2-9H,10H2,1H3,(H,19,22)(H,23,24)