N-[4-(3-methylphenyl)-3-(1,3-thiazol-5-yl)pyridin-2-yl]-1-phenyl-ethane-1,2-diamine

Systemtic Name: N-[4-(3-methylphenyl)-3-(1,3-thiazol-5-yl)pyridin-2-yl]-1-phenyl-ethane-1,2-diamine Openeye Name: N-[4-(m-tolyl)-3-thiazol-5-yl-2-pyridyl]-1-phenyl-ethane-1,2-diamine CAS Name: N-[4-(3-methylphenyl)-3-(5-thiazolyl)-2-pyridinyl]-1-phenylethane-1,2-diamine IUPAC Name: N-[4-(3-methylphenyl)-3-(1,3-thiazol-5-yl)pyridin-2-yl]-1-phenylethane-1,2-diamine Traditional Name: (2-amino-1-phenyl-ethyl)-[4-(m-tolyl)-3-thiazol-5-yl-2-pyridyl]amine Formula: C23H22N4S MolecularWeight: 386.51258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(C(=NC=C2)NC(CN)C3=CC=CC=C3)C4=CN=CS4

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(C(=NC=C2)NC(CN)C3=CC=CC=C3)C4=CN=CS4

InChI

InChI=1S/C23H22N4S/c1-16-6-5-9-18(12-16)19-10-11-26-23(22(19)21-14-25-15-28-21)27-20(13-24)17-7-3-2-4-8-17/h2-12,14-15,20H,13,24H2,1H3,(H,26,27)