S-carbamimidoyl 2-(2-azanylethyl)hexanethioate; sulfuric acid

Systemtic Name: S-carbamimidoyl 2-(2-azanylethyl)hexanethioate; sulfuric acid Openeye Name: S-carbamimidoyl 2-(2-aminoethyl)hexanethioate; sulfuric acid CAS Name: 2-(2-aminoethyl)hexanethioic acid S-carbamimidoyl ester; sulfuric acid IUPAC Name: S-carbamimidoyl 2-(2-aminoethyl)hexanethioate; sulfuric acid Traditional Name: 2-(2-aminoethyl)hexanethioic acid S-amidino ester; sulfuric acid Formula: C9H21N3O5S2 MolecularWeight: 315.41014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCN)C(=O)SC(=N)N.OS(=O)(=O)O

Isomeric SMILES

CCCCC(CCN)C(=O)SC(=N)N.OS(=O)(=O)O

InChI

InChI=1S/C9H19N3OS.H2O4S/c1-2-3-4-7(5-6-10)8(13)14-9(11)12;1-5(2,3)4/h7H,2-6,10H2,1H3,(H3,11,12);(H2,1,2,3,4)