4-[2-(3,4-dichlorophenyl)ethanoyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-sulfonamide

Systemtic Name: 4-[2-(3,4-dichlorophenyl)ethanoyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-sulfonamide Openeye Name: 4-[2-(3,4-dichlorophenyl)acetyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-sulfonamide CAS Name: 4-[2-(3,4-dichlorophenyl)-1-oxoethyl]-3-(1-pyrrolidinylmethyl)-1-piperazinesulfonamide IUPAC Name: 4-[2-(3,4-dichlorophenyl)acetyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-sulfonamide Traditional Name: 4-[2-(3,4-dichlorophenyl)acetyl]-3-(pyrrolidinomethyl)piperazine-1-sulfonamide Formula: C17H24Cl2N4O3S MolecularWeight: 435.36846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2CN(CCN2C(=O)CC3=CC(=C(C=C3)Cl)Cl)S(=O)(=O)N

Isomeric SMILES

C1CCN(C1)CC2CN(CCN2C(=O)CC3=CC(=C(C=C3)Cl)Cl)S(=O)(=O)N

InChI

InChI=1S/C17H24Cl2N4O3S/c18-15-4-3-13(9-16(15)19)10-17(24)23-8-7-22(27(20,25)26)12-14(23)11-21-5-1-2-6-21/h3-4,9,14H,1-2,5-8,10-12H2,(H2,20,25,26)