2,4-bis(chloranyl)-N-[2-[(E)-3-[2-(5,6-diphenyl-2,5-dihydro-1,2,4-triazin-3-yl)hydrazinyl]-1-phenyl-prop-2-enyl]sulfanylphenyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[2-[(E)-3-[2-(5,6-diphenyl-2,5-dihydro-1,2,4-triazin-3-yl)hydrazinyl]-1-phenyl-prop-2-enyl]sulfanylphenyl]benzamide Openeye Name: 2,4-dichloro-N-[2-[(E)-3-[2-(5,6-diphenyl-2,5-dihydro-1,2,4-triazin-3-yl)hydrazino]-1-phenyl-allyl]sulfanylphenyl]benzamide CAS Name: 2,4-dichloro-N-[2-[[(E)-3-[(5,6-diphenyl-2,5-dihydro-1,2,4-triazin-3-yl)hydrazo]-1-phenylprop-2-enyl]thio]phenyl]benzamide IUPAC Name: 2,4-dichloro-N-[2-[(E)-3-[2-(5,6-diphenyl-2,5-dihydro-1,2,4-triazin-3-yl)hydrazinyl]-1-phenylprop-2-enyl]sulfanylphenyl]benzamide Traditional Name: 2,4-dichloro-N-[2-[[(E)-3-[N'-(5,6-diphenyl-2,5-dihydro-1,2,4-triazin-3-yl)hydrazino]-1-phenyl-allyl]thio]phenyl]benzamide Formula: C37H30Cl2N6OS MolecularWeight: 677.6447

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(=NNC(=N2)NNC=CC(C3=CC=CC=C3)SC4=CC=CC=C4NC(=O)C5=C(C=C(C=C5)Cl)Cl)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2C(=NNC(=N2)NN/C=C/C(C3=CC=CC=C3)SC4=CC=CC=C4NC(=O)C5=C(C=C(C=C5)Cl)Cl)C6=CC=CC=C6

InChI

InChI=1S/C37H30Cl2N6OS/c38-28-20-21-29(30(39)24-28)36(46)41-31-18-10-11-19-33(31)47-32(25-12-4-1-5-13-25)22-23-40-44-37-42-34(26-14-6-2-7-15-26)35(43-45-37)27-16-8-3-9-17-27/h1-24,32,34,40H,(H,41,46)(H2,42,44,45)/b23-22+