N-[2-[4-(4-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-N-propan-2-yl-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[4-(4-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-N-propan-2-yl-1,3-benzodioxole-5-carboxamide Openeye Name: N-isopropyl-N-[2-oxo-2-[4-(p-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-(4-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-propan-2-yl-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-(4-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-propan-2-yl-1,3-benzodioxole-5-carboxamide Traditional Name: N-isopropyl-N-[2-keto-2-[4-(p-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethyl]-piperonylamide Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3=C(CCN2C(=O)CN(C(C)C)C(=O)C4=CC5=C(C=C4)OCO5)SC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2C3=C(CCN2C(=O)CN(C(C)C)C(=O)C4=CC5=C(C=C4)OCO5)SC=C3

InChI

InChI=1S/C27H28N2O4S/c1-17(2)29(27(31)20-8-9-22-23(14-20)33-16-32-22)15-25(30)28-12-10-24-21(11-13-34-24)26(28)19-6-4-18(3)5-7-19/h4-9,11,13-14,17,26H,10,12,15-16H2,1-3H3