N'-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-2-[[4-(4-chlorophenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanehydrazide

Systemtic Name: N'-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-2-[[4-(4-chlorophenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanehydrazide Openeye Name: N'-[(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-2-[[4-(4-chlorophenyl)-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetohydrazide CAS Name: N'-[(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-2-[[4-(4-chlorophenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]acetohydrazide IUPAC Name: N'-[(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-[[4-(4-chlorophenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetohydrazide Traditional Name: N'-[(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]-2-[[4-(4-chlorophenyl)-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetohydrazide Formula: C25H21BrClN5O3S MolecularWeight: 586.88794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NNC=C4C=C(C(=O)C(=C4)Br)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NNC=C4C=C(C(=O)C(=C4)Br)OC

InChI

InChI=1S/C25H21BrClN5O3S/c1-15-3-5-17(6-4-15)24-30-31-25(32(24)19-9-7-18(27)8-10-19)36-14-22(33)29-28-13-16-11-20(26)23(34)21(12-16)35-2/h3-13,28H,14H2,1-2H3,(H,29,33)