1-(2,4-dichlorophenyl)-3-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl]thiourea

Systemtic Name: 1-(2,4-dichlorophenyl)-3-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl]thiourea Openeye Name: 1-(2,4-dichlorophenyl)-3-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl]thiourea CAS Name: 1-(2,4-dichlorophenyl)-3-[3-[4-(2,5-dimethylphenyl)-1-piperazinyl]propyl]thiourea IUPAC Name: 1-(2,4-dichlorophenyl)-3-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl]thiourea Traditional Name: 1-(2,4-dichlorophenyl)-3-[3-[4-(2,5-dimethylphenyl)piperazino]propyl]thiourea Formula: C22H28Cl2N4S MolecularWeight: 451.45552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)CCCNC(=S)NC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)CCCNC(=S)NC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H28Cl2N4S/c1-16-4-5-17(2)21(14-16)28-12-10-27(11-13-28)9-3-8-25-22(29)26-20-7-6-18(23)15-19(20)24/h4-7,14-15H,3,8-13H2,1-2H3,(H2,25,26,29)