3-[3,6-dimethyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]propyl carbamimidothioate

Systemtic Name: 3-[3,6-dimethyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]propyl carbamimidothioate Openeye Name: 2-[3-(3,6-dimethyl-2,4-dioxo-pyrimidin-1-yl)propyl]isothiourea CAS Name: carbamimidothioic acid 3-(3,6-dimethyl-2,4-dioxo-1-pyrimidinyl)propyl ester IUPAC Name: 3-(3,6-dimethyl-2,4-dioxopyrimidin-1-yl)propyl carbamimidothioate Traditional Name: 2-[3-(2,4-diketo-3,6-dimethyl-pyrimidin-1-yl)propyl]isothiourea Formula: C10H16N4O2S MolecularWeight: 256.32464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=O)N1CCCSC(=N)N)C

Isomeric SMILES

CC1=CC(=O)N(C(=O)N1CCCSC(=N)N)C

InChI

InChI=1S/C10H16N4O2S/c1-7-6-8(15)13(2)10(16)14(7)4-3-5-17-9(11)12/h6H,3-5H2,1-2H3,(H3,11,12)