2-[[5-(5-chloranyl-2-methoxy-phenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-amino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[[5-(5-chloranyl-2-methoxy-phenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-amino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[5-(5-chloro-2-methoxy-phenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl-methyl-amino]-N-isopropyl-acetamide CAS Name: 2-[[5-(5-chloro-2-methoxyphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methylamino]-N-propan-2-ylacetamide IUPAC Name: 2-[[5-(5-chloro-2-methoxyphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methylamino]-N-propan-2-ylacetamide Traditional Name: 2-[[5-(5-chloro-2-methoxy-phenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl-methyl-amino]-N-isopropyl-acetamide Formula: C16H22ClN5O2S MolecularWeight: 383.89618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN(C)CN1C(=S)N=C(N1)C2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CC(C)NC(=O)CN(C)CN1C(=S)N=C(N1)C2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C16H22ClN5O2S/c1-10(2)18-14(23)8-21(3)9-22-16(25)19-15(20-22)12-7-11(17)5-6-13(12)24-4/h5-7,10H,8-9H2,1-4H3,(H,18,23)(H,19,20,25)