N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(1-pyrrolyl)-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide Traditional Name: N-homopiperonyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC2=C1C(=C(S2)N3C=CC=C3)C(=O)NCCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CSCC2=C1C(=C(S2)N3C=CC=C3)C(=O)NCCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H20N2O3S2/c24-20(22-7-5-14-3-4-16-17(11-14)26-13-25-16)19-15-6-10-27-12-18(15)28-21(19)23-8-1-2-9-23/h1-4,8-9,11H,5-7,10,12-13H2,(H,22,24)