1-(2-cyanoethyl)-3-(4-methylphenyl)-1-(2-pyridin-2-ylethyl)thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(4-methylphenyl)-1-(2-pyridin-2-ylethyl)thiourea Openeye Name: 1-(2-cyanoethyl)-3-(p-tolyl)-1-[2-(2-pyridyl)ethyl]thiourea CAS Name: 1-(2-cyanoethyl)-3-(4-methylphenyl)-1-[2-(2-pyridinyl)ethyl]thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(4-methylphenyl)-1-(2-pyridin-2-ylethyl)thiourea Traditional Name: 1-(2-cyanoethyl)-3-(p-tolyl)-1-[2-(2-pyridyl)ethyl]thiourea Formula: C18H20N4S MolecularWeight: 324.4432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N(CCC#N)CCC2=CC=CC=N2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N(CCC#N)CCC2=CC=CC=N2

InChI

InChI=1S/C18H20N4S/c1-15-6-8-17(9-7-15)21-18(23)22(13-4-11-19)14-10-16-5-2-3-12-20-16/h2-3,5-9,12H,4,10,13-14H2,1H3,(H,21,23)