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

Systemtic Name: 3-(3-chlorophenyl)-1-(2-cyanoethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(3-chlorophenyl)-1-(2-cyanoethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-(3-chlorophenyl)-1-(2-cyanoethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(3-chlorophenyl)-1-(2-cyanoethyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(3-chlorophenyl)-1-(2-cyanoethyl)-1-(3-pyridylmethyl)thiourea Formula: C16H15ClN4S MolecularWeight: 330.8351

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC(=S)N(CCC#N)CC2=CN=CC=C2

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC(=S)N(CCC#N)CC2=CN=CC=C2

InChI

InChI=1S/C16H15ClN4S/c17-14-5-1-6-15(10-14)20-16(22)21(9-3-7-18)12-13-4-2-8-19-11-13/h1-2,4-6,8,10-11H,3,9,12H2,(H,20,22)