N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-1-(3,4-dimethylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-1-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-1-(3,4-dimethylphenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C25H33N5O3 MolecularWeight: 451.56122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NCCOC3=NC=NC(=C3)N4CCCCCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NCCOC3=NC=NC(=C3)N4CCCCCC4)C

InChI

InChI=1S/C25H33N5O3/c1-18-7-8-21(13-19(18)2)30-16-20(14-24(30)31)25(32)26-9-12-33-23-15-22(27-17-28-23)29-10-5-3-4-6-11-29/h7-8,13,15,17,20H,3-6,9-12,14,16H2,1-2H3,(H,26,32)