5-ethynyl-N-[(2R)-3-methoxy-1-[[3-methyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]amino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: 5-ethynyl-N-[(2R)-3-methoxy-1-[[3-methyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]amino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: 5-ethynyl-N-[(1R)-1-(methoxymethyl)-2-[3-methyl-4-(3-oxomorpholin-4-yl)anilino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: 5-ethynyl-N-[(2R)-3-methoxy-1-[3-methyl-4-(3-oxo-4-morpholinyl)anilino]-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: 5-ethynyl-N-[(2R)-3-methoxy-1-[3-methyl-4-(3-oxomorpholin-4-yl)anilino]-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: 5-ethynyl-N-[(1R)-2-keto-2-[4-(3-ketomorpholino)-3-methyl-anilino]-1-(methoxymethyl)ethyl]thiophene-2-carboxamide Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C(COC)NC(=O)C2=CC=C(S2)C#C)N3CCOCC3=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)[C@@H](COC)NC(=O)C2=CC=C(S2)C#C)N3CCOCC3=O

InChI

InChI=1S/C22H23N3O5S/c1-4-16-6-8-19(31-16)22(28)24-17(12-29-3)21(27)23-15-5-7-18(14(2)11-15)25-9-10-30-13-20(25)26/h1,5-8,11,17H,9-10,12-13H2,2-3H3,(H,23,27)(H,24,28)/t17-/m1/s1