2-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclohexyl-butanamide

Systemtic Name: 2-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclohexyl-butanamide Openeye Name: 2-[[5,6-bis(p-tolyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclohexyl-butanamide CAS Name: 2-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]thio]-N-cyclohexylbutanamide IUPAC Name: 2-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl]-N-cyclohexylbutanamide Traditional Name: 2-[[5,6-bis(p-tolyl)-1,2,4-triazin-3-yl]thio]-N-cyclohexyl-butyramide Formula: C27H32N4OS MolecularWeight: 460.63418

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1CCCCC1)SC2=NC(=C(N=N2)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C

Isomeric SMILES

CCC(C(=O)NC1CCCCC1)SC2=NC(=C(N=N2)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H32N4OS/c1-4-23(26(32)28-22-8-6-5-7-9-22)33-27-29-24(20-14-10-18(2)11-15-20)25(30-31-27)21-16-12-19(3)13-17-21/h10-17,22-23H,4-9H2,1-3H3,(H,28,32)