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

Systemtic Name: 1-(2,5-dimethylthiophen-3-yl)-4-[4-(phenylcarbonyl)piperidin-1-yl]butane-1,4-dione Openeye Name: 1-(4-benzoyl-1-piperidyl)-4-(2,5-dimethyl-3-thienyl)butane-1,4-dione CAS Name: 1-(4-benzoyl-1-piperidinyl)-4-(2,5-dimethyl-3-thiophenyl)butane-1,4-dione IUPAC Name: 1-(4-benzoylpiperidin-1-yl)-4-(2,5-dimethylthiophen-3-yl)butane-1,4-dione Traditional Name: 1-(4-benzoylpiperidino)-4-(2,5-dimethyl-3-thienyl)butane-1,4-dione Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)N2CCC(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)N2CCC(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H25NO3S/c1-15-14-19(16(2)27-15)20(24)8-9-21(25)23-12-10-18(11-13-23)22(26)17-6-4-3-5-7-17/h3-7,14,18H,8-13H2,1-2H3