N-(3-methyl-2-phenyl-butyl)-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-(3-methyl-2-phenyl-butyl)-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-(3-methyl-2-phenyl-butyl)-3-(1-piperidylsulfonyl)thiophene-2-carboxamide CAS Name: N-(3-methyl-2-phenylbutyl)-3-(1-piperidinylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-(3-methyl-2-phenylbutyl)-3-piperidin-1-ylsulfonylthiophene-2-carboxamide Traditional Name: N-(3-methyl-2-phenyl-butyl)-3-piperidinosulfonyl-thiophene-2-carboxamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)C1=C(C=CS1)S(=O)(=O)N2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CNC(=O)C1=C(C=CS1)S(=O)(=O)N2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C21H28N2O3S2/c1-16(2)18(17-9-5-3-6-10-17)15-22-21(24)20-19(11-14-27-20)28(25,26)23-12-7-4-8-13-23/h3,5-6,9-11,14,16,18H,4,7-8,12-13,15H2,1-2H3,(H,22,24)