6-(3-phenacylsulfanyl-4-phenethyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: 6-(3-phenacylsulfanyl-4-phenethyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: 6-(3-phenacylsulfanyl-4-phenethyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,4-dien-1-one CAS Name: 6-[3-(phenacylthio)-4-phenethyl-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-(3-phenacylsulfanyl-4-phenethyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: 6-[3-(phenacylthio)-4-phenethyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Formula: C24H21N3O2S MolecularWeight: 415.50744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=C3C=CC=CC3=O)NN=C2SCC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=C3C=CC=CC3=O)NN=C2SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H21N3O2S/c28-21-14-8-7-13-20(21)23-25-26-24(27(23)16-15-18-9-3-1-4-10-18)30-17-22(29)19-11-5-2-6-12-19/h1-14,25H,15-17H2