N-(2-chloranyl-5-nitro-phenyl)-2-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-[(5-isopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[(5-isopropyl-4-methyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C14H16ClN5O3S MolecularWeight: 369.82654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C)SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)C1=NN=C(N1C)SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H16ClN5O3S/c1-8(2)13-17-18-14(19(13)3)24-7-12(21)16-11-6-9(20(22)23)4-5-10(11)15/h4-6,8H,7H2,1-3H3,(H,16,21)