4-bromanylbutyl N'-(pyridin-3-ylmethylideneamino)carbamimidothioate hydrobromide

Systemtic Name: 4-bromanylbutyl N'-(pyridin-3-ylmethylideneamino)carbamimidothioate hydrobromide Openeye Name: 2-(4-bromobutyl)-3-(3-pyridylmethyleneamino)isothiourea hydrobromide CAS Name: N'-(3-pyridinylmethylideneamino)carbamimidothioic acid 4-bromobutyl ester hydrobromide IUPAC Name: 4-bromobutyl N'-(pyridin-3-ylmethylideneamino)carbamimidothioate hydrobromide Traditional Name: 2-(4-bromobutyl)-3-(3-pyridylmethyleneamino)isothiourea hydrobromide Formula: C11H16Br2N4S MolecularWeight: 396.14454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C=NN=C(N)SCCCCBr.Br

Isomeric SMILES

C1=CC(=CN=C1)C=NN=C(N)SCCCCBr.Br

InChI

InChI=1S/C11H15BrN4S.BrH/c12-5-1-2-7-17-11(13)16-15-9-10-4-3-6-14-8-10;/h3-4,6,8-9H,1-2,5,7H2,(H2,13,16);1H