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

Systemtic Name: N-[1-[[4-(2-azanylidenepiperidin-1-yl)-3-methyl-phenyl]amino]-2-methyl-1-oxidanylidene-propan-2-yl]-5-ethynyl-thiophene-2-carboxamide Openeye Name: 5-ethynyl-N-[2-[4-(2-imino-1-piperidyl)-3-methyl-anilino]-1,1-dimethyl-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: 5-ethynyl-N-[1-[4-(2-imino-1-piperidinyl)-3-methylanilino]-2-methyl-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: 5-ethynyl-N-[1-[4-(2-iminopiperidin-1-yl)-3-methylanilino]-2-methyl-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: 5-ethynyl-N-[2-[4-(2-iminopiperidino)-3-methyl-anilino]-2-keto-1,1-dimethyl-ethyl]thiophene-2-carboxamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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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)N3CCCCC3=N

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C(C)(C)NC(=O)C2=CC=C(S2)C#C)N3CCCCC3=N

InChI

InChI=1S/C23H26N4O2S/c1-5-17-10-12-19(30-17)21(28)26-23(3,4)22(29)25-16-9-11-18(15(2)14-16)27-13-7-6-8-20(27)24/h1,9-12,14,24H,6-8,13H2,2-4H3,(H,25,29)(H,26,28)