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

Systemtic Name: 3-cyclopentyl-2-[(2-nitrophenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-cyclopentyl-2-[(2-nitrophenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-cyclopentyl-2-[(2-nitrophenyl)methylthio]-4-quinazolinone IUPAC Name: 3-cyclopentyl-2-[(2-nitrophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-cyclopentyl-2-[(2-nitrobenzyl)thio]quinazolin-4-one Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O3S/c24-19-16-10-4-5-11-17(16)21-20(22(19)15-8-2-3-9-15)27-13-14-7-1-6-12-18(14)23(25)26/h1,4-7,10-12,15H,2-3,8-9,13H2