4,5-dimethyl-2-[2-[4-oxidanyl-4-(phenylmethyl)piperidin-1-yl]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 4,5-dimethyl-2-[2-[4-oxidanyl-4-(phenylmethyl)piperidin-1-yl]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-(4-benzyl-4-hydroxy-1-piperidyl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxamide CAS Name: 2-[[2-[4-hydroxy-4-(phenylmethyl)-1-piperidinyl]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxamide IUPAC Name: 2-[[2-(4-benzyl-4-hydroxypiperidin-1-yl)acetyl]amino]-4,5-dimethylthiophene-3-carboxamide Traditional Name: 2-[[2-(4-benzyl-4-hydroxy-piperidino)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)CN2CCC(CC2)(CC3=CC=CC=C3)O)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)CN2CCC(CC2)(CC3=CC=CC=C3)O)C

InChI

InChI=1S/C21H27N3O3S/c1-14-15(2)28-20(18(14)19(22)26)23-17(25)13-24-10-8-21(27,9-11-24)12-16-6-4-3-5-7-16/h3-7,27H,8-13H2,1-2H3,(H2,22,26)(H,23,25)