3-(4-chlorophenyl)-1,1-bis(2-cyanoethyl)thiourea

Systemtic Name: 3-(4-chlorophenyl)-1,1-bis(2-cyanoethyl)thiourea Openeye Name: 3-(4-chlorophenyl)-1,1-bis(2-cyanoethyl)thiourea CAS Name: 3-(4-chlorophenyl)-1,1-bis(2-cyanoethyl)thiourea IUPAC Name: 3-(4-chlorophenyl)-1,1-bis(2-cyanoethyl)thiourea Traditional Name: 3-(4-chlorophenyl)-1,1-bis(2-cyanoethyl)thiourea Formula: C13H13ClN4S MolecularWeight: 292.78712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)N(CCC#N)CCC#N)Cl

Isomeric SMILES

C1=CC(=CC=C1NC(=S)N(CCC#N)CCC#N)Cl

InChI

InChI=1S/C13H13ClN4S/c14-11-3-5-12(6-4-11)17-13(19)18(9-1-7-15)10-2-8-16/h3-6H,1-2,9-10H2,(H,17,19)