(6E)-6-[4-(2-methylphenyl)-3-propylsulfanyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[4-(2-methylphenyl)-3-propylsulfanyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[4-(o-tolyl)-3-propylsulfanyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[4-(2-methylphenyl)-3-(propylthio)-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[4-(2-methylphenyl)-3-propylsulfanyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[4-(o-tolyl)-3-(propylthio)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NNC(=C2C=CC=CC2=O)N1C3=CC=CC=C3C

Isomeric SMILES

CCCSC1=NN/C(=C/2\C=CC=CC2=O)/N1C3=CC=CC=C3C

InChI

InChI=1S/C18H19N3OS/c1-3-12-23-18-20-19-17(14-9-5-7-11-16(14)22)21(18)15-10-6-4-8-13(15)2/h4-11,19H,3,12H2,1-2H3/b17-14-