N-(3-methylbutyl)-N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]cyclohexanecarboxamide

Systemtic Name: N-(3-methylbutyl)-N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]cyclohexanecarboxamide Openeye Name: N-isopentyl-N-[2-[4-(o-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxo-ethyl]cyclohexanecarboxamide CAS Name: N-(3-methylbutyl)-N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]cyclohexanecarboxamide IUPAC Name: N-(3-methylbutyl)-N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]cyclohexanecarboxamide Traditional Name: N-isoamyl-N-[2-keto-2-[4-(o-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethyl]cyclohexanecarboxamide Formula: C28H38N2O2S MolecularWeight: 466.67852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C3=C(CCN2C(=O)CN(CCC(C)C)C(=O)C4CCCCC4)SC=C3

Isomeric SMILES

CC1=CC=CC=C1C2C3=C(CCN2C(=O)CN(CCC(C)C)C(=O)C4CCCCC4)SC=C3

InChI

InChI=1S/C28H38N2O2S/c1-20(2)13-16-29(28(32)22-10-5-4-6-11-22)19-26(31)30-17-14-25-24(15-18-33-25)27(30)23-12-8-7-9-21(23)3/h7-9,12,15,18,20,22,27H,4-6,10-11,13-14,16-17,19H2,1-3H3