N-[(2-methylcyclohexyl)carbamoyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2-methylcyclohexyl)carbamoyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-[(2-methylcyclohexyl)carbamoyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-[[(2-methylcyclohexyl)amino]-oxomethyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-[(2-methylcyclohexyl)carbamoyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-[(2-methylcyclohexyl)carbamoyl]-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C15H21N3O3S MolecularWeight: 323.41054

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)NC(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC1CCCCC1NC(=O)NC(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C15H21N3O3S/c1-11-6-2-3-7-12(11)16-15(20)17-13(19)10-22-14-8-4-5-9-18(14)21/h4-5,8-9,11-12H,2-3,6-7,10H2,1H3,(H2,16,17,19,20)