1-(2,5-dimethylthiophen-3-yl)-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butane-1,4-dione

Systemtic Name: 1-(2,5-dimethylthiophen-3-yl)-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butane-1,4-dione Openeye Name: 1-(2,5-dimethyl-3-thienyl)-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butane-1,4-dione CAS Name: 1-(2,5-dimethyl-3-thiophenyl)-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butane-1,4-dione IUPAC Name: 1-(2,5-dimethylthiophen-3-yl)-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butane-1,4-dione Traditional Name: 1-(2,5-dimethyl-3-thienyl)-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butane-1,4-dione Formula: C21H23NO2S MolecularWeight: 353.47782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO2S/c1-15-14-19(16(2)25-15)20(23)8-9-21(24)22-12-10-18(11-13-22)17-6-4-3-5-7-17/h3-7,10,14H,8-9,11-13H2,1-2H3