3-(4-methylphenyl)-1-(phenylmethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(4-methylphenyl)-1-(phenylmethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-benzyl-3-(p-tolyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-(4-methylphenyl)-1-(phenylmethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-benzyl-3-(4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-benzyl-3-(p-tolyl)-1-(3-pyridylmethyl)thiourea Formula: C21H21N3S MolecularWeight: 347.47654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N(CC2=CC=CC=C2)CC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N(CC2=CC=CC=C2)CC3=CN=CC=C3

InChI

InChI=1S/C21H21N3S/c1-17-9-11-20(12-10-17)23-21(25)24(15-18-6-3-2-4-7-18)16-19-8-5-13-22-14-19/h2-14H,15-16H2,1H3,(H,23,25)