3-(2-chlorophenyl)-1-(2-cyanoethyl)-1-methyl-thiourea

Systemtic Name: 3-(2-chlorophenyl)-1-(2-cyanoethyl)-1-methyl-thiourea Openeye Name: 3-(2-chlorophenyl)-1-(2-cyanoethyl)-1-methyl-thiourea CAS Name: 3-(2-chlorophenyl)-1-(2-cyanoethyl)-1-methylthiourea IUPAC Name: 3-(2-chlorophenyl)-1-(2-cyanoethyl)-1-methylthiourea Traditional Name: 3-(2-chlorophenyl)-1-(2-cyanoethyl)-1-methyl-thiourea Formula: C11H12ClN3S MolecularWeight: 253.75108

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=S)NC1=CC=CC=C1Cl

Isomeric SMILES

CN(CCC#N)C(=S)NC1=CC=CC=C1Cl

InChI

InChI=1S/C11H12ClN3S/c1-15(8-4-7-13)11(16)14-10-6-3-2-5-9(10)12/h2-3,5-6H,4,8H2,1H3,(H,14,16)