1-(2-cyanoethyl)-3-(diphenylmethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(diphenylmethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-benzhydryl-1-(2-cyanoethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-(2-cyanoethyl)-3-(diphenylmethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-benzhydryl-1-(2-cyanoethyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-benzhydryl-1-(2-cyanoethyl)-1-(3-pyridylmethyl)thiourea Formula: C23H22N4S MolecularWeight: 386.51258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=S)N(CCC#N)CC3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=S)N(CCC#N)CC3=CN=CC=C3

InChI

InChI=1S/C23H22N4S/c24-14-8-16-27(18-19-9-7-15-25-17-19)23(28)26-22(20-10-3-1-4-11-20)21-12-5-2-6-13-21/h1-7,9-13,15,17,22H,8,16,18H2,(H,26,28)