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

Systemtic Name: N-(4-acetamidophenyl)-2-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl]propanamide Openeye Name: N-(4-acetamidophenyl)-2-[[5,6-bis(p-tolyl)-1,2,4-triazin-3-yl]sulfanyl]propanamide CAS Name: N-(4-acetamidophenyl)-2-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-2-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl]propanamide Traditional Name: N-(4-acetamidophenyl)-2-[[5,6-bis(p-tolyl)-1,2,4-triazin-3-yl]thio]propionamide Formula: C28H27N5O2S MolecularWeight: 497.61128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=NC(=N2)SC(C)C(=O)NC3=CC=C(C=C3)NC(=O)C)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=NC(=N2)SC(C)C(=O)NC3=CC=C(C=C3)NC(=O)C)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H27N5O2S/c1-17-5-9-21(10-6-17)25-26(22-11-7-18(2)8-12-22)32-33-28(31-25)36-19(3)27(35)30-24-15-13-23(14-16-24)29-20(4)34/h5-16,19H,1-4H3,(H,29,34)(H,30,35)