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

Systemtic Name: 2-[[5-(5-chloranyl-2-methoxy-phenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(5-chloro-2-methoxy-phenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-(5-chloro-2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[5-(5-chloro-2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(5-chloro-2-methoxy-phenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C14H15ClN4O2S MolecularWeight: 338.8125

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=NN=C(N2CC=C)SCC(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=NN=C(N2CC=C)SCC(=O)N

InChI

InChI=1S/C14H15ClN4O2S/c1-3-6-19-13(17-18-14(19)22-8-12(16)20)10-7-9(15)4-5-11(10)21-2/h3-5,7H,1,6,8H2,2H3,(H2,16,20)