3-[2-(4-chlorophenyl)ethyl]-1-(cyanomethyl)-1-methyl-thiourea

Systemtic Name: 3-[2-(4-chlorophenyl)ethyl]-1-(cyanomethyl)-1-methyl-thiourea Openeye Name: 3-[2-(4-chlorophenyl)ethyl]-1-(cyanomethyl)-1-methyl-thiourea CAS Name: 3-[2-(4-chlorophenyl)ethyl]-1-(cyanomethyl)-1-methylthiourea IUPAC Name: 3-[2-(4-chlorophenyl)ethyl]-1-(cyanomethyl)-1-methylthiourea Traditional Name: 3-[2-(4-chlorophenyl)ethyl]-1-(cyanomethyl)-1-methyl-thiourea Formula: C12H14ClN3S MolecularWeight: 267.77766

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#N)C(=S)NCCC1=CC=C(C=C1)Cl

Isomeric SMILES

CN(CC#N)C(=S)NCCC1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H14ClN3S/c1-16(9-7-14)12(17)15-8-6-10-2-4-11(13)5-3-10/h2-5H,6,8-9H2,1H3,(H,15,17)