1-(2,5-dimethylthiophen-3-yl)-4-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]butane-1,4-dione

Systemtic Name: 1-(2,5-dimethylthiophen-3-yl)-4-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]butane-1,4-dione Openeye Name: 1-(2,5-dimethyl-3-thienyl)-4-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]butane-1,4-dione CAS Name: 1-(2,5-dimethyl-3-thiophenyl)-4-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]butane-1,4-dione IUPAC Name: 1-(2,5-dimethylthiophen-3-yl)-4-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]butane-1,4-dione Traditional Name: 1-(2,5-dimethyl-3-thienyl)-4-[4-(2-keto-3H-benzimidazol-1-yl)piperidino]butane-1,4-dione Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H25N3O3S/c1-14-13-17(15(2)29-14)20(26)7-8-21(27)24-11-9-16(10-12-24)25-19-6-4-3-5-18(19)23-22(25)28/h3-6,13,16H,7-12H2,1-2H3,(H,23,28)