[3,5-bis(carbamimidoylsulfanylmethyl)-2,4,6-trimethyl-phenyl]methyl carbamimidothioate

Systemtic Name: [3,5-bis(carbamimidoylsulfanylmethyl)-2,4,6-trimethyl-phenyl]methyl carbamimidothioate Openeye Name: 2-[[3,5-bis(carbamimidoylsulfanylmethyl)-2,4,6-trimethyl-phenyl]methyl]isothiourea CAS Name: carbamimidothioic acid [3,5-bis[(carbamimidoylthio)methyl]-2,4,6-trimethylphenyl]methyl ester IUPAC Name: [3,5-bis(carbamimidoylsulfanylmethyl)-2,4,6-trimethylphenyl]methyl carbamimidothioate Traditional Name: 2-[3,5-bis[(amidinothio)methyl]-2,4,6-trimethyl-benzyl]isothiourea Formula: C15H24N6S3 MolecularWeight: 384.58626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1CSC(=N)N)C)CSC(=N)N)C)CSC(=N)N

Isomeric SMILES

CC1=C(C(=C(C(=C1CSC(=N)N)C)CSC(=N)N)C)CSC(=N)N

InChI

InChI=1S/C15H24N6S3/c1-7-10(4-22-13(16)17)8(2)12(6-24-15(20)21)9(3)11(7)5-23-14(18)19/h4-6H2,1-3H3,(H3,16,17)(H3,18,19)(H3,20,21)