4-chloranyl-N-[[5-(2-phenylethanoylamino)thiophen-2-yl]-piperidin-1-ylsulfonyl-methyl]benzamide

Systemtic Name: 4-chloranyl-N-[[5-(2-phenylethanoylamino)thiophen-2-yl]-piperidin-1-ylsulfonyl-methyl]benzamide Openeye Name: 4-chloro-N-[[5-[(2-phenylacetyl)amino]-2-thienyl]-(1-piperidylsulfonyl)methyl]benzamide CAS Name: 4-chloro-N-[[5-[(1-oxo-2-phenylethyl)amino]-2-thiophenyl]-(1-piperidinylsulfonyl)methyl]benzamide IUPAC Name: 4-chloro-N-[[5-[(2-phenylacetyl)amino]thiophen-2-yl]-piperidin-1-ylsulfonylmethyl]benzamide Traditional Name: 4-chloro-N-[[5-[(2-phenylacetyl)amino]-2-thienyl]-piperidinosulfonyl-methyl]benzamide Formula: C25H26ClN3O4S2 MolecularWeight: 532.07464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C(C2=CC=C(S2)NC(=O)CC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C(C2=CC=C(S2)NC(=O)CC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H26ClN3O4S2/c26-20-11-9-19(10-12-20)24(31)28-25(35(32,33)29-15-5-2-6-16-29)21-13-14-23(34-21)27-22(30)17-18-7-3-1-4-8-18/h1,3-4,7-14,25H,2,5-6,15-17H2,(H,27,30)(H,28,31)