(3S)-N-cyclopropyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-cyclopropyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-cyclopropyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: (3S)-N-cyclopropyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-cyclopropyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-cyclopropyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C19H27N4O3S2+ MolecularWeight: 423.57268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)N(CC3=[N+](C=CN3)C)C4CC4

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)N(CC3=[N+](C=CN3)C)C4CC4

InChI

InChI=1S/C19H26N4O3S2/c1-14-5-8-18(27-14)28(25,26)22-10-3-4-15(12-22)19(24)23(16-6-7-16)13-17-20-9-11-21(17)2/h5,8-9,11,15-16H,3-4,6-7,10,12-13H2,1-2H3/p+1/t15-/m0/s1