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

Systemtic Name: N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxo-ethyl]-N-isobutyl-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-keto-ethyl]-N-isobutyl-piperonylamide Formula: C27H27ClN2O4S MolecularWeight: 511.03228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(=O)N1CCC2=C(C1C3=CC=C(C=C3)Cl)C=CS2)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C)CN(CC(=O)N1CCC2=C(C1C3=CC=C(C=C3)Cl)C=CS2)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H27ClN2O4S/c1-17(2)14-29(27(32)19-5-8-22-23(13-19)34-16-33-22)15-25(31)30-11-9-24-21(10-12-35-24)26(30)18-3-6-20(28)7-4-18/h3-8,10,12-13,17,26H,9,11,14-16H2,1-2H3