N-(2-methyl-3-pyrrol-1-yl-phenyl)-2-[[5-(3-nitrophenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-methyl-3-pyrrol-1-yl-phenyl)-2-[[5-(3-nitrophenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-methyl-3-pyrrol-1-yl-phenyl)-2-[[5-(3-nitrophenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[2-methyl-3-(1-pyrrolyl)phenyl]-2-[[5-(3-nitrophenyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-methyl-3-pyrrol-1-ylphenyl)-2-[[5-(3-nitrophenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-methyl-3-pyrrol-1-yl-phenyl)-2-[[5-(3-nitrophenyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C24H24N6O3S MolecularWeight: 476.55076

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2C)N3C=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2C)N3C=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H24N6O3S/c1-3-12-29-23(18-8-6-9-19(15-18)30(32)33)26-27-24(29)34-16-22(31)25-20-10-7-11-21(17(20)2)28-13-4-5-14-28/h4-11,13-15H,3,12,16H2,1-2H3,(H,25,31)