N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-4-(phenylsulfonyl)piperazine-1-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-4-(phenylsulfonyl)piperazine-1-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]piperazine-1-carboxamide CAS Name: 4-(benzenesulfonyl)-N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-1-piperazinecarboxamide IUPAC Name: 4-(benzenesulfonyl)-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]piperazine-1-carboxamide Traditional Name: 4-besyl-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]piperazine-1-carboxamide Formula: C19H26N4O3S2 MolecularWeight: 422.56474

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)C3=CSC=C3

Isomeric SMILES

CN(C)C(CNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)C3=CSC=C3

InChI

InChI=1S/C19H26N4O3S2/c1-21(2)18(16-8-13-27-15-16)14-20-19(24)22-9-11-23(12-10-22)28(25,26)17-6-4-3-5-7-17/h3-8,13,15,18H,9-12,14H2,1-2H3,(H,20,24)