[6-(carbamimidoylsulfanylmethyl)naphthalen-2-yl]methyl carbamimidothioate

Systemtic Name: [6-(carbamimidoylsulfanylmethyl)naphthalen-2-yl]methyl carbamimidothioate Openeye Name: 2-[[6-(carbamimidoylsulfanylmethyl)-2-naphthyl]methyl]isothiourea CAS Name: carbamimidothioic acid [6-[(carbamimidoylthio)methyl]-2-naphthalenyl]methyl ester IUPAC Name: [6-(carbamimidoylsulfanylmethyl)naphthalen-2-yl]methyl carbamimidothioate Traditional Name: 2-[[6-[(amidinothio)methyl]-2-naphthyl]methyl]isothiourea Formula: C14H16N4S2 MolecularWeight: 304.43364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)CSC(=N)N)C=C1CSC(=N)N

Isomeric SMILES

C1=CC2=C(C=CC(=C2)CSC(=N)N)C=C1CSC(=N)N

InChI

InChI=1S/C14H16N4S2/c15-13(16)19-7-9-1-3-11-6-10(8-20-14(17)18)2-4-12(11)5-9/h1-6H,7-8H2,(H3,15,16)(H3,17,18)