S-[(1-methyl-1,2,3,4-tetrazol-5-yl)] N-butyl-N-(2-oxidanylidene-2-pyrrolidin-2-yl-ethyl)carbamothioate hydrochloride

Systemtic Name: S-[(1-methyl-1,2,3,4-tetrazol-5-yl)] N-butyl-N-(2-oxidanylidene-2-pyrrolidin-2-yl-ethyl)carbamothioate hydrochloride Openeye Name: S-(1-methyltetrazol-5-yl) N-butyl-N-(2-oxo-2-pyrrolidin-2-yl-ethyl)carbamothioate hydrochloride CAS Name: N-butyl-N-[2-oxo-2-(2-pyrrolidinyl)ethyl]carbamothioic acid S-[(1-methyl-5-tetrazolyl)] ester hydrochloride IUPAC Name: S-(1-methyltetrazol-5-yl) N-butyl-N-(2-oxo-2-pyrrolidin-2-ylethyl)carbamothioate hydrochloride Traditional Name: N-butyl-N-(2-keto-2-pyrrolidin-2-yl-ethyl)thiocarbamic acid S-(1-methyltetrazol-5-yl) ester hydrochloride Formula: C13H23ClN6O2S MolecularWeight: 362.87872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)C1CCCN1)C(=O)SC2=NN=NN2C.Cl

Isomeric SMILES

CCCCN(CC(=O)C1CCCN1)C(=O)SC2=NN=NN2C.Cl

InChI

InChI=1S/C13H22N6O2S.ClH/c1-3-4-8-19(9-11(20)10-6-5-7-14-10)13(21)22-12-15-16-17-18(12)2;/h10,14H,3-9H2,1-2H3;1H