(E)-1-(4-chlorophenyl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-chlorophenyl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)prop-2-en-1-one Openeye Name: (E)-1-(4-chlorophenyl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)prop-2-en-1-one CAS Name: (E)-1-(4-chlorophenyl)-3-(1H-1,2,4-triazol-5-ylthio)-2-propen-1-one IUPAC Name: (E)-1-(4-chlorophenyl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)prop-2-en-1-one Traditional Name: (E)-1-(4-chlorophenyl)-3-(1H-1,2,4-triazol-5-ylthio)prop-2-en-1-one Formula: C11H8ClN3OS MolecularWeight: 265.71872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C=CSC2=NC=NN2)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)/C=C/SC2=NC=NN2)Cl

InChI

InChI=1S/C11H8ClN3OS/c12-9-3-1-8(2-4-9)10(16)5-6-17-11-13-7-14-15-11/h1-7H,(H,13,14,15)/b6-5+