3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-propan-2-yl-thiourea

Systemtic Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-propan-2-yl-thiourea Openeye Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-isopropyl-thiourea CAS Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-propan-2-ylthiourea IUPAC Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-propan-2-ylthiourea Traditional Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-isopropyl-thiourea Formula: C13H16ClN3S MolecularWeight: 281.80424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClN3S/c1-10(2)17(9-3-8-15)13(18)16-12-6-4-11(14)5-7-12/h4-7,10H,3,9H2,1-2H3,(H,16,18)