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

Systemtic Name: N-[1-[[4-(3-azanylidenemorpholin-4-yl)-3-methyl-phenyl]amino]-2-methyl-1-oxidanylidene-propan-2-yl]-5-ethynyl-thiophene-2-carboxamide Openeye Name: 5-ethynyl-N-[2-[4-(3-iminomorpholin-4-yl)-3-methyl-anilino]-1,1-dimethyl-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: 5-ethynyl-N-[1-[4-(3-imino-4-morpholinyl)-3-methylanilino]-2-methyl-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: 5-ethynyl-N-[1-[4-(3-iminomorpholin-4-yl)-3-methylanilino]-2-methyl-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: 5-ethynyl-N-[2-[4-(3-iminomorpholino)-3-methyl-anilino]-2-keto-1,1-dimethyl-ethyl]thiophene-2-carboxamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O3S/c1-5-16-7-9-18(30-16)20(27)25-22(3,4)21(28)24-15-6-8-17(14(2)12-15)26-10-11-29-13-19(26)23/h1,6-9,12,23H,10-11,13H2,2-4H3,(H,24,28)(H,25,27)