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

Systemtic Name: N-aminocarbonyl-2-[[5-(2,4-dichlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoyl-acetamide CAS Name: N-carbamoyl-2-[[5-(2,4-dichlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-carbamoyl-2-[[5-(2,4-dichlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]thio]-N-carbamoyl-acetamide Formula: C14H13Cl2N5O2S MolecularWeight: 386.25632

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC(=O)N)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC(=O)N)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H13Cl2N5O2S/c1-2-5-21-12(9-4-3-8(15)6-10(9)16)19-20-14(21)24-7-11(22)18-13(17)23/h2-4,6H,1,5,7H2,(H3,17,18,22,23)