3-(4-chlorophenyl)-1-[2-[(4-chlorophenyl)carbamothioylamino]ethyl]-1-phenyl-thiourea

Systemtic Name: 3-(4-chlorophenyl)-1-[2-[(4-chlorophenyl)carbamothioylamino]ethyl]-1-phenyl-thiourea Openeye Name: 3-(4-chlorophenyl)-1-[2-[(4-chlorophenyl)carbamothioylamino]ethyl]-1-phenyl-thiourea CAS Name: 1-[2-[[(4-chloroanilino)-sulfanylidenemethyl]amino]ethyl]-3-(4-chlorophenyl)-1-phenylthiourea IUPAC Name: 3-(4-chlorophenyl)-1-[2-[(4-chlorophenyl)carbamothioylamino]ethyl]-1-phenylthiourea Traditional Name: 3-(4-chlorophenyl)-1-[2-[(4-chlorophenyl)thiocarbamoylamino]ethyl]-1-phenyl-thiourea Formula: C22H20Cl2N4S2 MolecularWeight: 475.457

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCNC(=S)NC2=CC=C(C=C2)Cl)C(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)N(CCNC(=S)NC2=CC=C(C=C2)Cl)C(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H20Cl2N4S2/c23-16-6-10-18(11-7-16)26-21(29)25-14-15-28(20-4-2-1-3-5-20)22(30)27-19-12-8-17(24)9-13-19/h1-13H,14-15H2,(H,27,30)(H2,25,26,29)