N-[3-[(3aS)-5-(6-ethynyl-2,4-dimethyl-pyridin-3-yl)carbonyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl]-1-(3-fluorophenyl)propyl]oxolane-3-carboxamide

Systemtic Name: N-[3-[(3aS)-5-(6-ethynyl-2,4-dimethyl-pyridin-3-yl)carbonyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl]-1-(3-fluorophenyl)propyl]oxolane-3-carboxamide Openeye Name: N-[3-[(3aS)-5-(6-ethynyl-2,4-dimethyl-pyridine-3-carbonyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl]-1-(3-fluorophenyl)propyl]tetrahydrofuran-3-carboxamide CAS Name: N-[3-[(3aS)-5-[(6-ethynyl-2,4-dimethyl-3-pyridinyl)-oxomethyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl]-1-(3-fluorophenyl)propyl]-3-oxolanecarboxamide IUPAC Name: N-[3-[(3aS)-5-(6-ethynyl-2,4-dimethylpyridine-3-carbonyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl]-1-(3-fluorophenyl)propyl]oxolane-3-carboxamide Traditional Name: N-[3-[(3aS)-5-(6-ethynyl-2,4-dimethyl-nicotinoyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl]-1-(3-fluorophenyl)propyl]tetrahydrofuran-3-carboxamide Formula: C30H35FN4O3 MolecularWeight: 518.622303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1)C#C)C)C(=O)N2CC3CN(CC3C2)CCC(C4=CC(=CC=C4)F)NC(=O)C5CCOC5

Isomeric SMILES

CC1=C(C(=NC(=C1)C#C)C)C(=O)N2C[C@@H]3CN(CC3C2)CCC(C4=CC(=CC=C4)F)NC(=O)C5CCOC5

InChI

InChI=1S/C30H35FN4O3/c1-4-26-12-19(2)28(20(3)32-26)30(37)35-16-23-14-34(15-24(23)17-35)10-8-27(21-6-5-7-25(31)13-21)33-29(36)22-9-11-38-18-22/h1,5-7,12-13,22-24,27H,8-11,14-18H2,2-3H3,(H,33,36)/t22?,23-,24?,27?/m0/s1