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

Systemtic Name: 5-tert-butyl-N-[1-(2-methoxyethyl)-6-oxidanylidene-pyridin-3-yl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: 5-tert-butyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: 5-tert-butyl-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: 5-tert-butyl-N-[1-(2-methoxyethyl)-6-oxopyridin-3-yl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: 5-tert-butyl-N-[6-keto-1-(2-methoxyethyl)-3-pyridyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NC3=CN(C(=O)C=C3)CCOC

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NC3=CN(C(=O)C=C3)CCOC

InChI

InChI=1S/C21H28N2O3S/c1-21(2,3)15-5-7-17-14(11-15)12-18(27-17)20(25)22-16-6-8-19(24)23(13-16)9-10-26-4/h6,8,12-13,15H,5,7,9-11H2,1-4H3,(H,22,25)