(4-azanyl-2-methyl-pyrimidin-5-yl)methyl carbamimidothioate

Systemtic Name: (4-azanyl-2-methyl-pyrimidin-5-yl)methyl carbamimidothioate Openeye Name: 2-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]isothiourea CAS Name: carbamimidothioic acid (4-amino-2-methyl-5-pyrimidinyl)methyl ester IUPAC Name: (4-amino-2-methylpyrimidin-5-yl)methyl carbamimidothioate Traditional Name: 2-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]isothiourea Formula: C7H11N5S MolecularWeight: 197.26074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)N)CSC(=N)N

Isomeric SMILES

CC1=NC=C(C(=N1)N)CSC(=N)N

InChI

InChI=1S/C7H11N5S/c1-4-11-2-5(6(8)12-4)3-13-7(9)10/h2H,3H2,1H3,(H3,9,10)(H2,8,11,12)