2-[3-(2-carbamimidoylsulfanylpropan-2-yl)phenyl]propan-2-yl carbamimidothioate

Systemtic Name: 2-[3-(2-carbamimidoylsulfanylpropan-2-yl)phenyl]propan-2-yl carbamimidothioate Openeye Name: 2-[1-[3-(1-carbamimidoylsulfanyl-1-methyl-ethyl)phenyl]-1-methyl-ethyl]isothiourea CAS Name: carbamimidothioic acid 2-[3-[2-(carbamimidoylthio)propan-2-yl]phenyl]propan-2-yl ester IUPAC Name: 2-[3-(2-carbamimidoylsulfanylpropan-2-yl)phenyl]propan-2-yl carbamimidothioate Traditional Name: 2-[1-[3-[1-(amidinothio)-1-methyl-ethyl]phenyl]-1-methyl-ethyl]isothiourea Formula: C14H22N4S2 MolecularWeight: 310.48128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=CC=C1)C(C)(C)SC(=N)N)SC(=N)N

Isomeric SMILES

CC(C)(C1=CC(=CC=C1)C(C)(C)SC(=N)N)SC(=N)N

InChI

InChI=1S/C14H22N4S2/c1-13(2,19-11(15)16)9-6-5-7-10(8-9)14(3,4)20-12(17)18/h5-8H,1-4H3,(H3,15,16)(H3,17,18)