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4-[(N-propyl-C-pyrrolidin-1-yl-carbonimidoyl)sulfanylmethyl]benzoic acid hydrobromide

4-[(N-propyl-C-pyrrolidin-1-yl-carbonimidoyl)sulfanylmethyl]benzoic acid hydrobromide

Systemtic Name:4-[(N-propyl-C-pyrrolidin-1-yl-carbonimidoyl)sulfanylmethyl]benzoic acid hydrobromide
Openeye Name:4-[(N-propyl-C-pyrrolidin-1-yl-carbonimidoyl)sulfanylmethyl]benzoic acid hydrobromide
CAS Name:4-[[[propylimino(1-pyrrolidinyl)methyl]thio]methyl]benzoic acid hydrobromide
IUPAC Name:4-[(N-propyl-C-pyrrolidin-1-ylcarbonimidoyl)sulfanylmethyl]benzoic acid hydrobromide
Traditional Name:4-[[(N-propyl-C-pyrrolidino-carbonimidoyl)thio]methyl]benzoic acid hydrobromide
Formula: C16H23BrN2O2S
MolecularWeight: 387.33502
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Descriptors Computed from Structure

Canonical SMILES:

CCCN=C(N1CCCC1)SCC2=CC=C(C=C2)C(=O)O.Br


Isomeric SMILES

CCCN=C(N1CCCC1)SCC2=CC=C(C=C2)C(=O)O.Br


InChI

InChI=1S/C16H22N2O2S.BrH/c1-2-9-17-16(18-10-3-4-11-18)21-12-13-5-7-14(8-6-13)15(19)20;/h5-8H,2-4,9-12H2,1H3,(H,19,20);1H


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