N-(5-methylpyridin-2-yl)-1-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]piperidine-4-carboxamide

Systemtic Name: N-(5-methylpyridin-2-yl)-1-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]piperidine-4-carboxamide Openeye Name: N-(5-methyl-2-pyridyl)-1-(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-(5-methyl-2-pyridinyl)-1-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(5-methylpyridin-2-yl)-1-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-(5-methyl-2-pyridyl)-1-(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)isonipecotamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCC(CC3)C(=O)NC4=NC=C(C=C4)C

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCC(CC3)C(=O)NC4=NC=C(C=C4)C

InChI

InChI=1S/C22H27N3O2S/c1-14-3-5-18-17(11-14)12-19(28-18)22(27)25-9-7-16(8-10-25)21(26)24-20-6-4-15(2)13-23-20/h4,6,12-14,16H,3,5,7-11H2,1-2H3,(H,23,24,26)