3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-6-nitro-4-phenyl-1H-quinolin-2-one

Systemtic Name: 3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-6-nitro-4-phenyl-1H-quinolin-2-one Openeye Name: 3-(1-methyltetrazol-5-yl)sulfanyl-6-nitro-4-phenyl-1H-quinolin-2-one CAS Name: 3-[(1-methyl-5-tetrazolyl)thio]-6-nitro-4-phenyl-1H-quinolin-2-one IUPAC Name: 3-(1-methyltetrazol-5-yl)sulfanyl-6-nitro-4-phenyl-1H-quinolin-2-one Traditional Name: 3-[(1-methyltetrazol-5-yl)thio]-6-nitro-4-phenyl-carbostyril Formula: C17H12N6O3S MolecularWeight: 380.38058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SC2=C(C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)C4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=N1)SC2=C(C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)C4=CC=CC=C4

InChI

InChI=1S/C17H12N6O3S/c1-22-17(19-20-21-22)27-15-14(10-5-3-2-4-6-10)12-9-11(23(25)26)7-8-13(12)18-16(15)24/h2-9H,1H3,(H,18,24)