2-(2-azanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethyl carbamimidothioate

Systemtic Name: 2-(2-azanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethyl carbamimidothioate Openeye Name: 2-[2-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)ethyl]isothiourea CAS Name: carbamimidothioic acid 2-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)ethyl ester IUPAC Name: 2-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)ethyl carbamimidothioate Traditional Name: 2-[2-(2-amino-4-keto-6-methyl-1H-pyrimidin-5-yl)ethyl]isothiourea Formula: C8H13N5OS MolecularWeight: 227.28672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N)CCSC(=N)N

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N)CCSC(=N)N

InChI

InChI=1S/C8H13N5OS/c1-4-5(2-3-15-7(9)10)6(14)13-8(11)12-4/h2-3H2,1H3,(H3,9,10)(H3,11,12,13,14)