(phenylmethyl) N-[(2-azanyl-6-methyl-pyrimidin-4-yl)amino]carbamodithioate

Systemtic Name: (phenylmethyl) N-[(2-azanyl-6-methyl-pyrimidin-4-yl)amino]carbamodithioate Openeye Name: benzyl N-[(2-amino-6-methyl-pyrimidin-4-yl)amino]carbamodithioate CAS Name: N-[(2-amino-6-methyl-4-pyrimidinyl)amino]carbamodithioic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2-amino-6-methylpyrimidin-4-yl)amino]carbamodithioate Traditional Name: N-[(2-amino-6-methyl-pyrimidin-4-yl)amino]carbamodithioic acid benzyl ester Formula: C13H15N5S2 MolecularWeight: 305.4217

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N)NNC(=S)SCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=NC(=N1)N)NNC(=S)SCC2=CC=CC=C2

InChI

InChI=1S/C13H15N5S2/c1-9-7-11(16-12(14)15-9)17-18-13(19)20-8-10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,18,19)(H3,14,15,16,17)