6-cyclohexyl-3-(dimethylaminomethyl)-5-phenyl-4H-thieno[3,2-b]pyrrole-2-carboxylic acid

Systemtic Name: 6-cyclohexyl-3-(dimethylaminomethyl)-5-phenyl-4H-thieno[3,2-b]pyrrole-2-carboxylic acid Openeye Name: 6-cyclohexyl-3-(dimethylaminomethyl)-5-phenyl-4H-thieno[3,2-b]pyrrole-2-carboxylic acid CAS Name: 6-cyclohexyl-3-(dimethylaminomethyl)-5-phenyl-4H-thieno[3,2-b]pyrrole-2-carboxylic acid IUPAC Name: 6-cyclohexyl-3-(dimethylaminomethyl)-5-phenyl-4H-thieno[3,2-b]pyrrole-2-carboxylic acid Traditional Name: 6-cyclohexyl-3-(dimethylaminomethyl)-5-phenyl-4H-thieno[3,2-b]pyrrole-2-carboxylic acid Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(SC2=C1NC(=C2C3CCCCC3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CN(C)CC1=C(SC2=C1NC(=C2C3CCCCC3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C22H26N2O2S/c1-24(2)13-16-19-21(27-20(16)22(25)26)17(14-9-5-3-6-10-14)18(23-19)15-11-7-4-8-12-15/h4,7-8,11-12,14,23H,3,5-6,9-10,13H2,1-2H3,(H,25,26)