(3S)-N-(6-morpholin-4-ylpyridin-3-yl)-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(6-morpholin-4-ylpyridin-3-yl)-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(6-morpholino-3-pyridyl)-5-oxo-1-phenethyl-pyrrolidine-3-carboxamide CAS Name: (3S)-N-[6-(4-morpholinyl)-3-pyridinyl]-5-oxo-1-phenethyl-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(6-morpholin-4-ylpyridin-3-yl)-5-oxo-1-phenethylpyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-N-(6-morpholino-3-pyridyl)-1-phenethyl-pyrrolidine-3-carboxamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)NC(=O)C3CC(=O)N(C3)CCC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)NC(=O)[C@H]3CC(=O)N(C3)CCC4=CC=CC=C4

InChI

InChI=1S/C22H26N4O3/c27-21-14-18(16-26(21)9-8-17-4-2-1-3-5-17)22(28)24-19-6-7-20(23-15-19)25-10-12-29-13-11-25/h1-7,15,18H,8-14,16H2,(H,24,28)/t18-/m0/s1