3-cyclohexyl-1-[2-[4-(dimethylamino)piperidin-1-yl]-2-oxidanylidene-ethyl]-2-thiophen-3-yl-indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)piperidin-1-yl]-2-oxidanylidene-ethyl]-2-thiophen-3-yl-indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)-1-piperidyl]-2-oxo-ethyl]-2-(3-thienyl)indole-6-carboxylic acid CAS Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)-1-piperidinyl]-2-oxoethyl]-2-(3-thiophenyl)-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-2-thiophen-3-ylindole-6-carboxylic acid Traditional Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)piperidino]-2-keto-ethyl]-2-(3-thienyl)indole-6-carboxylic acid Formula: C28H35N3O3S MolecularWeight: 493.6608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(CC1)C(=O)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=CSC=C4)C5CCCCC5

Isomeric SMILES

CN(C)C1CCN(CC1)C(=O)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=CSC=C4)C5CCCCC5

InChI

InChI=1S/C28H35N3O3S/c1-29(2)22-10-13-30(14-11-22)25(32)17-31-24-16-20(28(33)34)8-9-23(24)26(19-6-4-3-5-7-19)27(31)21-12-15-35-18-21/h8-9,12,15-16,18-19,22H,3-7,10-11,13-14,17H2,1-2H3,(H,33,34)