N-[(1S)-2-methyl-1-thiophen-2-yl-propyl]-2-(4-piperidin-1-ylcarbonylpiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(1S)-2-methyl-1-thiophen-2-yl-propyl]-2-(4-piperidin-1-ylcarbonylpiperidin-1-ium-1-yl)ethanamide Openeye Name: N-[(1S)-2-methyl-1-(2-thienyl)propyl]-2-[4-(piperidine-1-carbonyl)piperidin-1-ium-1-yl]acetamide CAS Name: N-[(1S)-2-methyl-1-thiophen-2-ylpropyl]-2-[4-[oxo(1-piperidinyl)methyl]-1-piperidin-1-iumyl]acetamide IUPAC Name: N-[(1S)-2-methyl-1-thiophen-2-ylpropyl]-2-[4-(piperidine-1-carbonyl)piperidin-1-ium-1-yl]acetamide Traditional Name: N-[(1S)-2-methyl-1-(2-thienyl)propyl]-2-[4-(piperidine-1-carbonyl)piperidin-1-ium-1-yl]acetamide Formula: C21H34N3O2S+ MolecularWeight: 392.57856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC(=O)C[NH+]2CCC(CC2)C(=O)N3CCCCC3

Isomeric SMILES

CC(C)[C@@H](C1=CC=CS1)NC(=O)C[NH+]2CCC(CC2)C(=O)N3CCCCC3

InChI

InChI=1S/C21H33N3O2S/c1-16(2)20(18-7-6-14-27-18)22-19(25)15-23-12-8-17(9-13-23)21(26)24-10-4-3-5-11-24/h6-7,14,16-17,20H,3-5,8-13,15H2,1-2H3,(H,22,25)/p+1/t20-/m0/s1