4-(3,4-dichlorophenyl)-N-(4-morpholin-4-ylsulfonylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(3,4-dichlorophenyl)-N-(4-morpholin-4-ylsulfonylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(3,4-dichlorophenyl)-N-(4-morpholinosulfonylphenyl)piperazine-1-carbothioamide CAS Name: 4-(3,4-dichlorophenyl)-N-[4-(4-morpholinylsulfonyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-(3,4-dichlorophenyl)-N-(4-morpholin-4-ylsulfonylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(3,4-dichlorophenyl)-N-(4-morpholinosulfonylphenyl)piperazine-1-carbothioamide Formula: C21H24Cl2N4O3S2 MolecularWeight: 515.47626

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)Cl)Cl)C(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)Cl)Cl)C(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H24Cl2N4O3S2/c22-19-6-3-17(15-20(19)23)25-7-9-26(10-8-25)21(31)24-16-1-4-18(5-2-16)32(28,29)27-11-13-30-14-12-27/h1-6,15H,7-14H2,(H,24,31)