2-butyl-6-methyl-3-(2-phenoxyethyl)pyrimidin-4-one; 5-methylidene-1,3-thiazolidine-2,4-dione

Systemtic Name: 2-butyl-6-methyl-3-(2-phenoxyethyl)pyrimidin-4-one; 5-methylidene-1,3-thiazolidine-2,4-dione Openeye Name: 2-butyl-6-methyl-3-(2-phenoxyethyl)pyrimidin-4-one; 5-methylenethiazolidine-2,4-dione CAS Name: 2-butyl-6-methyl-3-(2-phenoxyethyl)-4-pyrimidinone; 5-methylenethiazolidine-2,4-dione IUPAC Name: 2-butyl-6-methyl-3-(2-phenoxyethyl)pyrimidin-4-one; 5-methylidene-1,3-thiazolidine-2,4-dione Traditional Name: 2-butyl-6-methyl-3-(2-phenoxyethyl)pyrimidin-4-one; 5-methylenethiazolidine-2,4-quinone Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CC(=O)N1CCOC2=CC=CC=C2)C.C=C1C(=O)NC(=O)S1

Isomeric SMILES

CCCCC1=NC(=CC(=O)N1CCOC2=CC=CC=C2)C.C=C1C(=O)NC(=O)S1

InChI

InChI=1S/C17H22N2O2.C4H3NO2S/c1-3-4-10-16-18-14(2)13-17(20)19(16)11-12-21-15-8-6-5-7-9-15;1-2-3(6)5-4(7)8-2/h5-9,13H,3-4,10-12H2,1-2H3;1H2,(H,5,6,7)