2-[(4-nitrophenyl)methylsulfanyl]-3-(4-propan-2-ylphenyl)quinazolin-4-one

Systemtic Name: 2-[(4-nitrophenyl)methylsulfanyl]-3-(4-propan-2-ylphenyl)quinazolin-4-one Openeye Name: 3-(4-isopropylphenyl)-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-one CAS Name: 2-[(4-nitrophenyl)methylthio]-3-(4-propan-2-ylphenyl)-4-quinazolinone IUPAC Name: 2-[(4-nitrophenyl)methylsulfanyl]-3-(4-propan-2-ylphenyl)quinazolin-4-one Traditional Name: 2-[(4-nitrobenzyl)thio]-3-p-cumenyl-quinazolin-4-one Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H21N3O3S/c1-16(2)18-9-13-19(14-10-18)26-23(28)21-5-3-4-6-22(21)25-24(26)31-15-17-7-11-20(12-8-17)27(29)30/h3-14,16H,15H2,1-2H3