N-[1-(phenylmethyl)piperidin-4-yl]-4-(3-thiophen-2-ylsulfonylpropanoylamino)benzamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-4-yl]-4-(3-thiophen-2-ylsulfonylpropanoylamino)benzamide Openeye Name: N-(1-benzyl-4-piperidyl)-4-[3-(2-thienylsulfonyl)propanoylamino]benzamide CAS Name: 4-[(1-oxo-3-thiophen-2-ylsulfonylpropyl)amino]-N-[1-(phenylmethyl)-4-piperidinyl]benzamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-4-(3-thiophen-2-ylsulfonylpropanoylamino)benzamide Traditional Name: N-(1-benzyl-4-piperidyl)-4-[3-(2-thienylsulfonyl)propanoylamino]benzamide Formula: C26H29N3O4S2 MolecularWeight: 511.65616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=C(C=C2)NC(=O)CCS(=O)(=O)C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=C(C=C2)NC(=O)CCS(=O)(=O)C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O4S2/c30-24(14-18-35(32,33)25-7-4-17-34-25)27-22-10-8-21(9-11-22)26(31)28-23-12-15-29(16-13-23)19-20-5-2-1-3-6-20/h1-11,17,23H,12-16,18-19H2,(H,27,30)(H,28,31)