2-[2-[(4-chlorophenyl)amino]-4-phenyl-1,3-thiazol-5-yl]-3-(4-ethanoylphenyl)quinazolin-4-one

Systemtic Name: 2-[2-[(4-chlorophenyl)amino]-4-phenyl-1,3-thiazol-5-yl]-3-(4-ethanoylphenyl)quinazolin-4-one Openeye Name: 3-(4-acetylphenyl)-2-[2-(4-chloroanilino)-4-phenyl-thiazol-5-yl]quinazolin-4-one CAS Name: 3-(4-acetylphenyl)-2-[2-(4-chloroanilino)-4-phenyl-5-thiazolyl]-4-quinazolinone IUPAC Name: 3-(4-acetylphenyl)-2-[2-(4-chloroanilino)-4-phenyl-1,3-thiazol-5-yl]quinazolin-4-one Traditional Name: 3-(4-acetylphenyl)-2-[2-(4-chloroanilino)-4-phenyl-thiazol-5-yl]quinazolin-4-one Formula: C31H21ClN4O2S MolecularWeight: 549.04204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)C4=C(N=C(S4)NC5=CC=C(C=C5)Cl)C6=CC=CC=C6

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)C4=C(N=C(S4)NC5=CC=C(C=C5)Cl)C6=CC=CC=C6

InChI

InChI=1S/C31H21ClN4O2S/c1-19(37)20-11-17-24(18-12-20)36-29(34-26-10-6-5-9-25(26)30(36)38)28-27(21-7-3-2-4-8-21)35-31(39-28)33-23-15-13-22(32)14-16-23/h2-18H,1H3,(H,33,35)