1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-5-keto-pyrrolidine-3-carboxamide Formula: C25H24N4O4S MolecularWeight: 476.54746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3CC(=O)N(C3)C4=CC5=C(C=C4)OCCO5)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3CC(=O)N(C3)C4=CC5=C(C=C4)OCCO5)C

InChI

InChI=1S/C25H24N4O4S/c1-15-11-16(2)27-25(26-15)34-20-6-3-18(4-7-20)28-24(31)17-12-23(30)29(14-17)19-5-8-21-22(13-19)33-10-9-32-21/h3-8,11,13,17H,9-10,12,14H2,1-2H3,(H,28,31)