N-(2-acetamidoethyl)-4-phenyl-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-acetamidoethyl)-4-phenyl-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-acetamidoethyl)-4-phenyl-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2-acetamidoethyl)-4-phenyl-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-acetamidoethyl)-4-phenyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(2-acetamidoethyl)-4-phenyl-1-(2-thienylsulfonyl)isonipecotamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NCCNC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C20H25N3O4S2/c1-16(24)21-11-12-22-19(25)20(17-6-3-2-4-7-17)9-13-23(14-10-20)29(26,27)18-8-5-15-28-18/h2-8,15H,9-14H2,1H3,(H,21,24)(H,22,25)