4-(2,5-dimethylthiophen-3-yl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-4-oxidanylidene-butanamide

Systemtic Name: 4-(2,5-dimethylthiophen-3-yl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-4-oxidanylidene-butanamide Openeye Name: 4-(2,5-dimethyl-3-thienyl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-4-oxo-butanamide CAS Name: 4-(2,5-dimethyl-3-thiophenyl)-N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]-4-oxobutanamide IUPAC Name: 4-(2,5-dimethylthiophen-3-yl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-4-oxobutanamide Traditional Name: 4-(2,5-dimethyl-3-thienyl)-4-keto-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]butyramide Formula: C21H33N2O3S+ MolecularWeight: 393.56332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)NCC2(CCCCC2)[NH+]3CCOCC3

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)NCC2(CCCCC2)[NH+]3CCOCC3

InChI

InChI=1S/C21H32N2O3S/c1-16-14-18(17(2)27-16)19(24)6-7-20(25)22-15-21(8-4-3-5-9-21)23-10-12-26-13-11-23/h14H,3-13,15H2,1-2H3,(H,22,25)/p+1