4-[[2,6-bis(chloranyl)phenyl]methyl]-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[[2,6-bis(chloranyl)phenyl]methyl]-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(2,6-dichlorophenyl)methyl]-N-(4-isopropylphenyl)piperazine-1-carbothioamide CAS Name: 4-[(2,6-dichlorophenyl)methyl]-N-(4-propan-2-ylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(2,6-dichlorophenyl)methyl]-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2,6-dichlorobenzyl)-N-p-cumenyl-piperazine-1-carbothioamide Formula: C21H25Cl2N3S MolecularWeight: 422.4143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C21H25Cl2N3S/c1-15(2)16-6-8-17(9-7-16)24-21(27)26-12-10-25(11-13-26)14-18-19(22)4-3-5-20(18)23/h3-9,15H,10-14H2,1-2H3,(H,24,27)