[4-(carbamimidoylsulfanylmethyl)phenyl]methyl carbamimidothioate

Systemtic Name: [4-(carbamimidoylsulfanylmethyl)phenyl]methyl carbamimidothioate Openeye Name: 2-[[4-(carbamimidoylsulfanylmethyl)phenyl]methyl]isothiourea CAS Name: carbamimidothioic acid [4-[(carbamimidoylthio)methyl]phenyl]methyl ester IUPAC Name: [4-(carbamimidoylsulfanylmethyl)phenyl]methyl carbamimidothioate Traditional Name: 2-[4-[(amidinothio)methyl]benzyl]isothiourea Formula: C10H14N4S2 MolecularWeight: 254.37496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC(=N)N)CSC(=N)N

Isomeric SMILES

C1=CC(=CC=C1CSC(=N)N)CSC(=N)N

InChI

InChI=1S/C10H14N4S2/c11-9(12)15-5-7-1-2-8(4-3-7)6-16-10(13)14/h1-4H,5-6H2,(H3,11,12)(H3,13,14)