3-cyclohexyl-2-[1-(3-nitrophenyl)ethylsulfanyl]quinazolin-4-one

Systemtic Name: 3-cyclohexyl-2-[1-(3-nitrophenyl)ethylsulfanyl]quinazolin-4-one Openeye Name: 3-cyclohexyl-2-[1-(3-nitrophenyl)ethylsulfanyl]quinazolin-4-one CAS Name: 3-cyclohexyl-2-[1-(3-nitrophenyl)ethylthio]-4-quinazolinone IUPAC Name: 3-cyclohexyl-2-[1-(3-nitrophenyl)ethylsulfanyl]quinazolin-4-one Traditional Name: 3-cyclohexyl-2-[1-(3-nitrophenyl)ethylthio]quinazolin-4-one Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NC3=CC=CC=C3C(=O)N2C4CCCCC4

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NC3=CC=CC=C3C(=O)N2C4CCCCC4

InChI

InChI=1S/C22H23N3O3S/c1-15(16-8-7-11-18(14-16)25(27)28)29-22-23-20-13-6-5-12-19(20)21(26)24(22)17-9-3-2-4-10-17/h5-8,11-15,17H,2-4,9-10H2,1H3