1-(3-chlorophenyl)-3-[6-[(3-chlorophenyl)carbamothioylamino]hexyl]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[6-[(3-chlorophenyl)carbamothioylamino]hexyl]thiourea Openeye Name: 1-(3-chlorophenyl)-3-[6-[(3-chlorophenyl)carbamothioylamino]hexyl]thiourea CAS Name: 1-[6-[[(3-chloroanilino)-sulfanylidenemethyl]amino]hexyl]-3-(3-chlorophenyl)thiourea IUPAC Name: 1-(3-chlorophenyl)-3-[6-[(3-chlorophenyl)carbamothioylamino]hexyl]thiourea Traditional Name: 1-(3-chlorophenyl)-3-[6-[(3-chlorophenyl)thiocarbamoylamino]hexyl]thiourea Formula: C20H24Cl2N4S2 MolecularWeight: 455.46736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC(=S)NCCCCCCNC(=S)NC2=CC(=CC=C2)Cl

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC(=S)NCCCCCCNC(=S)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C20H24Cl2N4S2/c21-15-7-5-9-17(13-15)25-19(27)23-11-3-1-2-4-12-24-20(28)26-18-10-6-8-16(22)14-18/h5-10,13-14H,1-4,11-12H2,(H2,23,25,27)(H2,24,26,28)