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

Systemtic Name: 5-ethynyl-N-[1-[[3-methyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]amino]-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: 5-ethynyl-N-[1-[[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]carbamoyl]propyl]thiophene-2-carboxamide CAS Name: 5-ethynyl-N-[1-[3-methyl-4-(3-oxo-4-morpholinyl)anilino]-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: 5-ethynyl-N-[1-[3-methyl-4-(3-oxomorpholin-4-yl)anilino]-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: 5-ethynyl-N-[1-[[4-(3-ketomorpholino)-3-methyl-phenyl]carbamoyl]propyl]thiophene-2-carboxamide Formula: C22H23N3O4S MolecularWeight: 425.50072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1)N2CCOCC2=O)C)NC(=O)C3=CC=C(S3)C#C

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1)N2CCOCC2=O)C)NC(=O)C3=CC=C(S3)C#C

InChI

InChI=1S/C22H23N3O4S/c1-4-16-7-9-19(30-16)22(28)24-17(5-2)21(27)23-15-6-8-18(14(3)12-15)25-10-11-29-13-20(25)26/h1,6-9,12,17H,5,10-11,13H2,2-3H3,(H,23,27)(H,24,28)