2,3-dimethyl-7-nitro-5-phenylsulfanyl-quinazolin-4-one

Systemtic Name: 2,3-dimethyl-7-nitro-5-phenylsulfanyl-quinazolin-4-one Openeye Name: 2,3-dimethyl-7-nitro-5-phenylsulfanyl-quinazolin-4-one CAS Name: 2,3-dimethyl-7-nitro-5-(phenylthio)-4-quinazolinone IUPAC Name: 2,3-dimethyl-7-nitro-5-phenylsulfanylquinazolin-4-one Traditional Name: 2,3-dimethyl-7-nitro-5-(phenylthio)quinazolin-4-one Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=CC(=C2C(=O)N1C)SC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC(=CC(=C2C(=O)N1C)SC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O3S/c1-10-17-13-8-11(19(21)22)9-14(15(13)16(20)18(10)2)23-12-6-4-3-5-7-12/h3-9H,1-2H3