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

Systemtic Name: 3-(3-chlorophenyl)-1-(2-cyanoethyl)-1-methyl-thiourea Openeye Name: 3-(3-chlorophenyl)-1-(2-cyanoethyl)-1-methyl-thiourea CAS Name: 3-(3-chlorophenyl)-1-(2-cyanoethyl)-1-methylthiourea IUPAC Name: 3-(3-chlorophenyl)-1-(2-cyanoethyl)-1-methylthiourea Traditional Name: 3-(3-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=C1)Cl

Isomeric SMILES

CN(CCC#N)C(=S)NC1=CC(=CC=C1)Cl

InChI

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