N-(4-methyl-3-nitro-phenyl)-2-[[4-methyl-5-(3-oxidanylidenenaphthalen-2-ylidene)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-2-[[4-methyl-5-(3-oxidanylidenenaphthalen-2-ylidene)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-methyl-3-nitro-phenyl)-2-[[4-methyl-5-(3-oxo-2-naphthylidene)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-methyl-3-nitrophenyl)-2-[[4-methyl-5-(3-oxo-2-naphthalenylidene)-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-methyl-3-nitrophenyl)-2-[[4-methyl-5-(3-oxonaphthalen-2-ylidene)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(3-keto-2-naphthylidene)-4-methyl-1H-1,2,4-triazol-3-yl]thio]-N-(4-methyl-3-nitro-phenyl)acetamide Formula: C22H19N5O4S MolecularWeight: 449.48236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NNC(=C3C=C4C=CC=CC4=CC3=O)N2C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NNC(=C3C=C4C=CC=CC4=CC3=O)N2C)[N+](=O)[O-]

InChI

InChI=1S/C22H19N5O4S/c1-13-7-8-16(11-18(13)27(30)31)23-20(29)12-32-22-25-24-21(26(22)2)17-9-14-5-3-4-6-15(14)10-19(17)28/h3-11,24H,12H2,1-2H3,(H,23,29)