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

Systemtic Name: 3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-6-nitro-4-phenyl-1H-quinolin-2-one Openeye Name: 3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-6-nitro-4-phenyl-1H-quinolin-2-one CAS Name: 3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-6-nitro-4-phenyl-1H-quinolin-2-one IUPAC Name: 3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-6-nitro-4-phenyl-1H-quinolin-2-one Traditional Name: 3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-6-nitro-4-phenyl-carbostyril Formula: C25H19N5O3S MolecularWeight: 469.51506

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=C(C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCN1C(=NN=C1SC2=C(C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H19N5O3S/c1-2-29-23(17-11-7-4-8-12-17)27-28-25(29)34-22-21(16-9-5-3-6-10-16)19-15-18(30(32)33)13-14-20(19)26-24(22)31/h3-15H,2H2,1H3,(H,26,31)