N-cyclohexyl-2-[[5-(3-nitrophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-cyclohexyl-2-[[5-(3-nitrophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-cyclohexyl-2-[[5-(3-nitrophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-cyclohexyl-2-[[5-(3-nitrophenyl)-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-cyclohexyl-2-[[5-(3-nitrophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-cyclohexyl-2-[[5-(3-nitrophenyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C16H19N5O3S MolecularWeight: 361.41876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSC2=NNC(=N2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)CSC2=NNC(=N2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O3S/c22-14(17-12-6-2-1-3-7-12)10-25-16-18-15(19-20-16)11-5-4-8-13(9-11)21(23)24/h4-5,8-9,12H,1-3,6-7,10H2,(H,17,22)(H,18,19,20)