1-(4-ethoxyphenyl)-3-(4-methylpyrimidin-2-yl)sulfanyl-pyrrolidine-2,5-dione

Systemtic Name: 1-(4-ethoxyphenyl)-3-(4-methylpyrimidin-2-yl)sulfanyl-pyrrolidine-2,5-dione Openeye Name: 1-(4-ethoxyphenyl)-3-(4-methylpyrimidin-2-yl)sulfanyl-pyrrolidine-2,5-dione CAS Name: 1-(4-ethoxyphenyl)-3-[(4-methyl-2-pyrimidinyl)thio]pyrrolidine-2,5-dione IUPAC Name: 1-(4-ethoxyphenyl)-3-(4-methylpyrimidin-2-yl)sulfanylpyrrolidine-2,5-dione Traditional Name: 3-[(4-methylpyrimidin-2-yl)thio]-1-p-phenetyl-pyrrolidine-2,5-quinone Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=NC=CC(=N3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=NC=CC(=N3)C

InChI

InChI=1S/C17H17N3O3S/c1-3-23-13-6-4-12(5-7-13)20-15(21)10-14(16(20)22)24-17-18-9-8-11(2)19-17/h4-9,14H,3,10H2,1-2H3