2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-naphthalen-2-yl-ethanone

Systemtic Name: 2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-naphthalen-2-yl-ethanone Openeye Name: 2-[[4-allyl-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2-naphthyl)ethanone CAS Name: 2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-1-(2-naphthalenyl)ethanone IUPAC Name: 2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-naphthalen-2-ylethanone Traditional Name: 2-[[4-allyl-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]-1-(2-naphthyl)ethanone Formula: C23H18ClN3OS MolecularWeight: 419.92652

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)C2=CC3=CC=CC=C3C=C2)C4=CC(=CC=C4)Cl

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)C2=CC3=CC=CC=C3C=C2)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H18ClN3OS/c1-2-12-27-22(19-8-5-9-20(24)14-19)25-26-23(27)29-15-21(28)18-11-10-16-6-3-4-7-17(16)13-18/h2-11,13-14H,1,12,15H2