1-(5-methylthiophen-2-yl)-7-(2-pyridin-4-ylpyrrolidin-1-yl)heptane-1,4,7-trione

Systemtic Name: 1-(5-methylthiophen-2-yl)-7-(2-pyridin-4-ylpyrrolidin-1-yl)heptane-1,4,7-trione Openeye Name: 1-(5-methyl-2-thienyl)-7-[2-(4-pyridyl)pyrrolidin-1-yl]heptane-1,4,7-trione CAS Name: 1-(5-methyl-2-thiophenyl)-7-(2-pyridin-4-yl-1-pyrrolidinyl)heptane-1,4,7-trione IUPAC Name: 1-(5-methylthiophen-2-yl)-7-(2-pyridin-4-ylpyrrolidin-1-yl)heptane-1,4,7-trione Traditional Name: 1-(5-methyl-2-thienyl)-7-[2-(4-pyridyl)pyrrolidino]heptane-1,4,7-trione Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)N2CCCC2C3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)N2CCCC2C3=CC=NC=C3

InChI

InChI=1S/C21H24N2O3S/c1-15-4-8-20(27-15)19(25)7-5-17(24)6-9-21(26)23-14-2-3-18(23)16-10-12-22-13-11-16/h4,8,10-13,18H,2-3,5-7,9,14H2,1H3