2-azanylethyl N'-naphthalen-2-ylcarbamimidothioate; sulfuric acid

Systemtic Name: 2-azanylethyl N'-naphthalen-2-ylcarbamimidothioate; sulfuric acid Openeye Name: 2-(2-aminoethyl)-3-(2-naphthyl)isothiourea; sulfuric acid CAS Name: N'-(2-naphthalenyl)carbamimidothioic acid 2-aminoethyl ester; sulfuric acid IUPAC Name: 2-aminoethyl N'-naphthalen-2-ylcarbamimidothioate; sulfuric acid Traditional Name: 2-(2-aminoethyl)-3-(2-naphthyl)isothiourea; sulfuric acid Formula: C13H17N3O4S2 MolecularWeight: 343.42178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)N=C(N)SCCN.OS(=O)(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)N=C(N)SCCN.OS(=O)(=O)O

InChI

InChI=1S/C13H15N3S.H2O4S/c14-7-8-17-13(15)16-12-6-5-10-3-1-2-4-11(10)9-12;1-5(2,3)4/h1-6,9H,7-8,14H2,(H2,15,16);(H2,1,2,3,4)