2-(4-methylphenyl)sulfonyl-3,6,7-triphenyl-1,2,4-triazepine

Systemtic Name: 2-(4-methylphenyl)sulfonyl-3,6,7-triphenyl-1,2,4-triazepine Openeye Name: 3,6,7-triphenyl-2-(p-tolylsulfonyl)-1,2,4-triazepine CAS Name: 2-(4-methylphenyl)sulfonyl-3,6,7-triphenyl-1,2,4-triazepine IUPAC Name: 2-(4-methylphenyl)sulfonyl-3,6,7-triphenyl-1,2,4-triazepine Traditional Name: 3,6,7-triphenyl-2-tosyl-1,2,4-triazepine Formula: C29H23N3O2S MolecularWeight: 477.57682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=NC=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=NC=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H23N3O2S/c1-22-17-19-26(20-18-22)35(33,34)32-29(25-15-9-4-10-16-25)30-21-27(23-11-5-2-6-12-23)28(31-32)24-13-7-3-8-14-24/h2-21H,1H3