cyclohexyl-[2-[(2-ethanoyl-4,6-dimethyl-thieno[2,3-b]pyridin-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: cyclohexyl-[2-[(2-ethanoyl-4,6-dimethyl-thieno[2,3-b]pyridin-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-[(2-acetyl-4,6-dimethyl-thieno[2,3-b]pyridin-3-yl)amino]-2-oxo-ethyl]-cyclohexyl-methyl-ammonium CAS Name: [2-[(2-acetyl-4,6-dimethyl-3-thieno[2,3-b]pyridinyl)amino]-2-oxoethyl]-cyclohexyl-methylammonium IUPAC Name: [2-[(2-acetyl-4,6-dimethylthieno[2,3-b]pyridin-3-yl)amino]-2-oxoethyl]-cyclohexyl-methylazanium Traditional Name: [2-[(2-acetyl-4,6-dimethyl-thieno[2,3-b]pyridin-3-yl)amino]-2-keto-ethyl]-cyclohexyl-methyl-ammonium Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)C)NC(=O)C[NH+](C)C3CCCCC3)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)C)NC(=O)C[NH+](C)C3CCCCC3)C

InChI

InChI=1S/C20H27N3O2S/c1-12-10-13(2)21-20-17(12)18(19(26-20)14(3)24)22-16(25)11-23(4)15-8-6-5-7-9-15/h10,15H,5-9,11H2,1-4H3,(H,22,25)/p+1