(5R)-5-tert-butyl-N-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: (5R)-5-tert-butyl-N-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5R)-5-tert-butyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5R)-5-tert-butyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5R)-5-tert-butyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5R)-5-tert-butyl-N-[(2-keto-4,6-dimethyl-1H-pyridin-3-yl)methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)CNC(=O)C2=CC3=C(S2)CCC(C3)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1)CNC(=O)C2=CC3=C(S2)CC[C@H](C3)C(C)(C)C)C

InChI

InChI=1S/C21H28N2O2S/c1-12-8-13(2)23-19(24)16(12)11-22-20(25)18-10-14-9-15(21(3,4)5)6-7-17(14)26-18/h8,10,15H,6-7,9,11H2,1-5H3,(H,22,25)(H,23,24)/t15-/m1/s1