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

Systemtic Name: 2-[[5-(2,4-dichlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-yl-ethanamide Openeye Name: 2-[[4-allyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-isopropyl-acetamide CAS Name: 2-[[5-(2,4-dichlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-N-propan-2-ylacetamide IUPAC Name: 2-[[5-(2,4-dichlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-ylacetamide Traditional Name: 2-[[4-allyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]thio]-N-isopropyl-acetamide Formula: C16H18Cl2N4OS MolecularWeight: 385.31132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=NN=C(N1CC=C)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)NC(=O)CSC1=NN=C(N1CC=C)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H18Cl2N4OS/c1-4-7-22-15(12-6-5-11(17)8-13(12)18)20-21-16(22)24-9-14(23)19-10(2)3/h4-6,8,10H,1,7,9H2,2-3H3,(H,19,23)