2-[(5S)-5-azanyl-6-(2-cyanopyrrolidin-1-yl)-6-oxidanylidene-hexyl]-1-methylsulfonyl-guanidine hydrochloride

Systemtic Name: 2-[(5S)-5-azanyl-6-(2-cyanopyrrolidin-1-yl)-6-oxidanylidene-hexyl]-1-methylsulfonyl-guanidine hydrochloride Openeye Name: 2-[(5S)-5-amino-6-(2-cyanopyrrolidin-1-yl)-6-oxo-hexyl]-1-methylsulfonyl-guanidine hydrochloride CAS Name: 2-[(5S)-5-amino-6-(2-cyano-1-pyrrolidinyl)-6-oxohexyl]-1-methylsulfonylguanidine hydrochloride IUPAC Name: 2-[(5S)-5-amino-6-(2-cyanopyrrolidin-1-yl)-6-oxohexyl]-1-methylsulfonylguanidine hydrochloride Traditional Name: 2-[(5S)-5-amino-6-(2-cyanopyrrolidino)-6-keto-hexyl]-1-mesyl-guanidine hydrochloride Formula: C13H25ClN6O3S MolecularWeight: 380.894

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC(=NCCCCC(C(=O)N1CCCC1C#N)N)N.Cl

Isomeric SMILES

CS(=O)(=O)NC(=NCCCC[C@@H](C(=O)N1CCCC1C#N)N)N.Cl

InChI

InChI=1S/C13H24N6O3S.ClH/c1-23(21,22)18-13(16)17-7-3-2-6-11(15)12(20)19-8-4-5-10(19)9-14;/h10-11H,2-8,15H2,1H3,(H3,16,17,18);1H/t10?,11-;/m0./s1