(5S)-N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: (5S)-N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-N-[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-N-[1-(4-acetamidophenyl)sulfonyl-4-piperidinyl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-N-[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C23H29N3O4S2 MolecularWeight: 475.62406

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NC3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NC3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C23H29N3O4S2/c1-15-3-8-21-17(13-15)14-22(31-21)23(28)25-19-9-11-26(12-10-19)32(29,30)20-6-4-18(5-7-20)24-16(2)27/h4-7,14-15,19H,3,8-13H2,1-2H3,(H,24,27)(H,25,28)/t15-/m0/s1