1,2-bis(benzotriazol-1-yl)-2-(4-methylphenyl)imino-ethanethione

Systemtic Name: 1,2-bis(benzotriazol-1-yl)-2-(4-methylphenyl)imino-ethanethione Openeye Name: 1,2-bis(benzotriazol-1-yl)-2-(p-tolylimino)ethanethione CAS Name: 1,2-bis(1-benzotriazolyl)-2-(4-methylphenyl)iminoethanethione IUPAC Name: 1,2-bis(benzotriazol-1-yl)-2-(4-methylphenyl)iminoethanethione Traditional Name: 1,2-bis(benzotriazol-1-yl)-2-(p-tolylimino)ethanethione Formula: C21H15N7S MolecularWeight: 397.4557

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C(C(=S)N2C3=CC=CC=C3N=N2)N4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=CC=C(C=C1)N=C(C(=S)N2C3=CC=CC=C3N=N2)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C21H15N7S/c1-14-10-12-15(13-11-14)22-20(27-18-8-4-2-6-16(18)23-25-27)21(29)28-19-9-5-3-7-17(19)24-26-28/h2-13H,1H3