2-(3-methylphenyl)-3-[(4-methylsulfanylphenyl)methylamino]quinazolin-4-one

Systemtic Name: 2-(3-methylphenyl)-3-[(4-methylsulfanylphenyl)methylamino]quinazolin-4-one Openeye Name: 3-[(4-methylsulfanylphenyl)methylamino]-2-(m-tolyl)quinazolin-4-one CAS Name: 2-(3-methylphenyl)-3-[[4-(methylthio)phenyl]methylamino]-4-quinazolinone IUPAC Name: 2-(3-methylphenyl)-3-[(4-methylsulfanylphenyl)methylamino]quinazolin-4-one Traditional Name: 3-[[4-(methylthio)benzyl]amino]-2-(m-tolyl)quinazolin-4-one Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=O)N2NCC4=CC=C(C=C4)SC

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=O)N2NCC4=CC=C(C=C4)SC

InChI

InChI=1S/C23H21N3OS/c1-16-6-5-7-18(14-16)22-25-21-9-4-3-8-20(21)23(27)26(22)24-15-17-10-12-19(28-2)13-11-17/h3-14,24H,15H2,1-2H3