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

Systemtic Name: 2-[1-(3-nitrophenyl)ethylsulfanyl]-3-propan-2-yl-quinazolin-4-one Openeye Name: 3-isopropyl-2-[1-(3-nitrophenyl)ethylsulfanyl]quinazolin-4-one CAS Name: 2-[1-(3-nitrophenyl)ethylthio]-3-propan-2-yl-4-quinazolinone IUPAC Name: 2-[1-(3-nitrophenyl)ethylsulfanyl]-3-propan-2-ylquinazolin-4-one Traditional Name: 3-isopropyl-2-[1-(3-nitrophenyl)ethylthio]quinazolin-4-one Formula: C19H19N3O3S MolecularWeight: 369.43746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SC(C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SC(C)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O3S/c1-12(2)21-18(23)16-9-4-5-10-17(16)20-19(21)26-13(3)14-7-6-8-15(11-14)22(24)25/h4-13H,1-3H3