2,4-bis(chloranyl)-N-[1-(5-phenacylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)ethyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[1-(5-phenacylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)ethyl]benzamide Openeye Name: N-[1-(4-allyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)ethyl]-2,4-dichloro-benzamide CAS Name: 2,4-dichloro-N-[1-[5-(phenacylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide IUPAC Name: 2,4-dichloro-N-[1-(5-phenacylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)ethyl]benzamide Traditional Name: N-[1-[4-allyl-5-(phenacylthio)-1,2,4-triazol-3-yl]ethyl]-2,4-dichloro-benzamide Formula: C22H20Cl2N4O2S MolecularWeight: 475.3908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(N1CC=C)SCC(=O)C2=CC=CC=C2)NC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C1=NN=C(N1CC=C)SCC(=O)C2=CC=CC=C2)NC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H20Cl2N4O2S/c1-3-11-28-20(14(2)25-21(30)17-10-9-16(23)12-18(17)24)26-27-22(28)31-13-19(29)15-7-5-4-6-8-15/h3-10,12,14H,1,11,13H2,2H3,(H,25,30)