4-(3-methylphenyl)-N-[2-(phenylmethyl)hexyl]-3-(1,3-thiazol-5-yl)pyridin-2-amine

Systemtic Name: 4-(3-methylphenyl)-N-[2-(phenylmethyl)hexyl]-3-(1,3-thiazol-5-yl)pyridin-2-amine Openeye Name: N-(2-benzylhexyl)-4-(m-tolyl)-3-thiazol-5-yl-pyridin-2-amine CAS Name: 4-(3-methylphenyl)-N-[2-(phenylmethyl)hexyl]-3-(5-thiazolyl)-2-pyridinamine IUPAC Name: N-(2-benzylhexyl)-4-(3-methylphenyl)-3-(1,3-thiazol-5-yl)pyridin-2-amine Traditional Name: 2-benzylhexyl-[4-(m-tolyl)-3-thiazol-5-yl-2-pyridyl]amine Formula: C28H31N3S MolecularWeight: 441.63084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=CC=CC=C1)CNC2=NC=CC(=C2C3=CN=CS3)C4=CC(=CC=C4)C

Isomeric SMILES

CCCCC(CC1=CC=CC=C1)CNC2=NC=CC(=C2C3=CN=CS3)C4=CC(=CC=C4)C

InChI

InChI=1S/C28H31N3S/c1-3-4-10-23(17-22-11-6-5-7-12-22)18-31-28-27(26-19-29-20-32-26)25(14-15-30-28)24-13-8-9-21(2)16-24/h5-9,11-16,19-20,23H,3-4,10,17-18H2,1-2H3,(H,30,31)