2-[[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methylsulfanyl]-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylate

Systemtic Name: 2-[[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methylsulfanyl]-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylate Openeye Name: 2-[[2-(4-methylanilino)thiazol-4-yl]methylsulfanyl]-4-oxo-3-phenyl-quinazoline-7-carboxylate CAS Name: 2-[[2-(4-methylanilino)-4-thiazolyl]methylthio]-4-oxo-3-phenyl-7-quinazolinecarboxylate IUPAC Name: 2-[[2-(4-methylanilino)-1,3-thiazol-4-yl]methylsulfanyl]-4-oxo-3-phenylquinazoline-7-carboxylate Traditional Name: 4-keto-3-phenyl-2-[[2-(p-toluidino)thiazol-4-yl]methylthio]quinazoline-7-carboxylate Formula: C26H19N4O3S2- MolecularWeight: 499.58406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)CSC3=NC4=C(C=CC(=C4)C(=O)[O-])C(=O)N3C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)CSC3=NC4=C(C=CC(=C4)C(=O)[O-])C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C26H20N4O3S2/c1-16-7-10-18(11-8-16)27-25-28-19(14-34-25)15-35-26-29-22-13-17(24(32)33)9-12-21(22)23(31)30(26)20-5-3-2-4-6-20/h2-14H,15H2,1H3,(H,27,28)(H,32,33)/p-1