6-[5-[(4-methylphenyl)methylsulfanyl]-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[5-[(4-methylphenyl)methylsulfanyl]-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[5-(p-tolylmethylsulfanyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[5-[(4-methylphenyl)methylthio]-1,2-dihydro-1,2,4-triazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[5-[(4-methylphenyl)methylsulfanyl]-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[5-[(4-methylbenzyl)thio]-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC(=C3C=CC=CC3=O)NN2

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC(=C3C=CC=CC3=O)NN2

InChI

InChI=1S/C16H15N3OS/c1-11-6-8-12(9-7-11)10-21-16-17-15(18-19-16)13-4-2-3-5-14(13)20/h2-9,18H,10H2,1H3,(H,17,19)