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

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[(5-propan-2-yl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-isopropyl-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-propan-2-yl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-[(5-propan-2-yl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-isopropyl-1,2,4-triazol-3-yl)thio]-N-(4-chloro-2,5-dimethoxy-phenyl)acetamide Formula: C18H23ClN4O3S MolecularWeight: 410.91822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1CC=C)SCC(=O)NC2=CC(=C(C=C2OC)Cl)OC

Isomeric SMILES

CC(C)C1=NN=C(N1CC=C)SCC(=O)NC2=CC(=C(C=C2OC)Cl)OC

InChI

InChI=1S/C18H23ClN4O3S/c1-6-7-23-17(11(2)3)21-22-18(23)27-10-16(24)20-13-9-14(25-4)12(19)8-15(13)26-5/h6,8-9,11H,1,7,10H2,2-5H3,(H,20,24)