(phenylmethyl) N'-(2,4-dimethylpentyl)carbamimidothioate; sulfuric acid

Systemtic Name: (phenylmethyl) N'-(2,4-dimethylpentyl)carbamimidothioate; sulfuric acid Openeye Name: 2-benzyl-3-(2,4-dimethylpentyl)isothiourea; sulfuric acid CAS Name: N'-(2,4-dimethylpentyl)carbamimidothioic acid (phenylmethyl) ester; sulfuric acid IUPAC Name: benzyl N'-(2,4-dimethylpentyl)carbamimidothioate; sulfuric acid Traditional Name: 2-benzyl-3-(2,4-dimethylpentyl)isothiourea; sulfuric acid Formula: C15H26N2O4S2 MolecularWeight: 362.50794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)CN=C(N)SCC1=CC=CC=C1.OS(=O)(=O)O

Isomeric SMILES

CC(C)CC(C)CN=C(N)SCC1=CC=CC=C1.OS(=O)(=O)O

InChI

InChI=1S/C15H24N2S.H2O4S/c1-12(2)9-13(3)10-17-15(16)18-11-14-7-5-4-6-8-14;1-5(2,3)4/h4-8,12-13H,9-11H2,1-3H3,(H2,16,17);(H2,1,2,3,4)