N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-chloro-2,5-dimethoxy-phenyl)acetamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-ethyl-1,2,4-triazol-3-yl)thio]-N-(4-chloro-2,5-dimethoxy-phenyl)acetamide Formula: C17H21ClN4O3S MolecularWeight: 396.89164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC=C)SCC(=O)NC2=CC(=C(C=C2OC)Cl)OC

Isomeric SMILES

CCC1=NN=C(N1CC=C)SCC(=O)NC2=CC(=C(C=C2OC)Cl)OC

InChI

InChI=1S/C17H21ClN4O3S/c1-5-7-22-15(6-2)20-21-17(22)26-10-16(23)19-12-9-13(24-3)11(18)8-14(12)25-4/h5,8-9H,1,6-7,10H2,2-4H3,(H,19,23)