N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[[[(1S,2S)-2-methylcyclohexyl]amino]-oxomethyl]-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-[4-(2-thenoyl)piperazin-1-ium-1-yl]acetamide Formula: C19H29N4O3S+ MolecularWeight: 393.52356

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C19H28N4O3S/c1-14-5-2-3-6-15(14)20-19(26)21-17(24)13-22-8-10-23(11-9-22)18(25)16-7-4-12-27-16/h4,7,12,14-15H,2-3,5-6,8-11,13H2,1H3,(H2,20,21,24,26)/p+1/t14-,15-/m0/s1