7-methyl-2-(4-methylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-methyl-2-(4-methylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-methyl-2-(p-tolyl)-5-(2-thienyl)-4H-1,3,4-benzotriazepine CAS Name: 7-methyl-2-(4-methylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-methyl-2-(4-methylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-methyl-2-(p-tolyl)-5-(2-thienyl)-4H-1,3,4-benzotriazepine Formula: C20H17N3S MolecularWeight: 331.43408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)C)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)C)C4=CC=CS4

InChI

InChI=1S/C20H17N3S/c1-13-5-8-15(9-6-13)20-21-17-10-7-14(2)12-16(17)19(22-23-20)18-4-3-11-24-18/h3-12,22H,1-2H3