6-cyclohexyl-4-[2-(dimethylamino)-2-oxidanylidene-ethyl]-5-phenyl-3a,6a-dihydrothieno[3,2-b]pyrrole-2-carboxylic acid

Systemtic Name: 6-cyclohexyl-4-[2-(dimethylamino)-2-oxidanylidene-ethyl]-5-phenyl-3a,6a-dihydrothieno[3,2-b]pyrrole-2-carboxylic acid Openeye Name: 6-cyclohexyl-4-[2-(dimethylamino)-2-oxo-ethyl]-5-phenyl-3a,6a-dihydrothieno[3,2-b]pyrrole-2-carboxylic acid CAS Name: 6-cyclohexyl-4-[2-(dimethylamino)-2-oxoethyl]-5-phenyl-3a,6a-dihydrothieno[3,2-b]pyrrole-2-carboxylic acid IUPAC Name: 6-cyclohexyl-4-[2-(dimethylamino)-2-oxoethyl]-5-phenyl-3a,6a-dihydrothieno[3,2-b]pyrrole-2-carboxylic acid Traditional Name: 6-cyclohexyl-4-[2-(dimethylamino)-2-keto-ethyl]-5-phenyl-3a,6a-dihydrothieno[3,2-b]pyrrole-2-carboxylic acid Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1C2C=C(SC2C(=C1C3=CC=CC=C3)C4CCCCC4)C(=O)O

Isomeric SMILES

CN(C)C(=O)CN1C2C=C(SC2C(=C1C3=CC=CC=C3)C4CCCCC4)C(=O)O

InChI

InChI=1S/C23H28N2O3S/c1-24(2)19(26)14-25-17-13-18(23(27)28)29-22(17)20(15-9-5-3-6-10-15)21(25)16-11-7-4-8-12-16/h4,7-8,11-13,15,17,22H,3,5-6,9-10,14H2,1-2H3,(H,27,28)