3-[(5-ethynylthiophen-2-yl)carbonylamino]-1-methyl-N-[3-methyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]pyrrolidine-3-carboxamide

Systemtic Name: 3-[(5-ethynylthiophen-2-yl)carbonylamino]-1-methyl-N-[3-methyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]pyrrolidine-3-carboxamide Openeye Name: 3-[(5-ethynylthiophene-2-carbonyl)amino]-1-methyl-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]pyrrolidine-3-carboxamide CAS Name: 3-[[(5-ethynyl-2-thiophenyl)-oxomethyl]amino]-1-methyl-N-[3-methyl-4-(3-oxo-4-morpholinyl)phenyl]-3-pyrrolidinecarboxamide IUPAC Name: 3-[(5-ethynylthiophene-2-carbonyl)amino]-1-methyl-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]pyrrolidine-3-carboxamide Traditional Name: 3-[(5-ethynylthiophene-2-carbonyl)amino]-N-[4-(3-ketomorpholino)-3-methyl-phenyl]-1-methyl-pyrrolidine-3-carboxamide Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2(CCN(C2)C)NC(=O)C3=CC=C(S3)C#C)N4CCOCC4=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2(CCN(C2)C)NC(=O)C3=CC=C(S3)C#C)N4CCOCC4=O

InChI

InChI=1S/C24H26N4O4S/c1-4-18-6-8-20(33-18)22(30)26-24(9-10-27(3)15-24)23(31)25-17-5-7-19(16(2)13-17)28-11-12-32-14-21(28)29/h1,5-8,13H,9-12,14-15H2,2-3H3,(H,25,31)(H,26,30)