3-(2-methylpropyl)-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-methylpropyl)-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-isobutyl-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2-methylpropyl)-2-[[(1R)-1-(3-nitrophenyl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-(2-methylpropyl)-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanylquinazolin-4-one Traditional Name: 3-isobutyl-2-[[(1R)-1-(3-nitrophenyl)ethyl]thio]quinazolin-4-one Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])SC2=NC3=CC=CC=C3C(=O)N2CC(C)C

InChI

InChI=1S/C20H21N3O3S/c1-13(2)12-22-19(24)17-9-4-5-10-18(17)21-20(22)27-14(3)15-7-6-8-16(11-15)23(25)26/h4-11,13-14H,12H2,1-3H3/t14-/m1/s1