3-[(4-methoxyphenyl)methyl]-5-(4-methylphenyl)-4H-1,3,4-benzotriazepine-2-thione

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-5-(4-methylphenyl)-4H-1,3,4-benzotriazepine-2-thione Openeye Name: 3-[(4-methoxyphenyl)methyl]-5-(p-tolyl)-4H-1,3,4-benzotriazepine-2-thione CAS Name: 3-[(4-methoxyphenyl)methyl]-5-(4-methylphenyl)-4H-1,3,4-benzotriazepine-2-thione IUPAC Name: 3-[(4-methoxyphenyl)methyl]-5-(4-methylphenyl)-4H-1,3,4-benzotriazepine-2-thione Traditional Name: 3-p-anisyl-5-(p-tolyl)-4H-1,3,4-benzotriazepine-2-thione Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=CC=CC3=NC(=S)N(N2)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=CC=CC3=NC(=S)N(N2)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C23H21N3OS/c1-16-7-11-18(12-8-16)22-20-5-3-4-6-21(20)24-23(28)26(25-22)15-17-9-13-19(27-2)14-10-17/h3-14,25H,15H2,1-2H3