2-azanyl-5-(2,2-dimethylthian-4-yl)-4-sulfanyl-1H-pyrimidin-6-one

Systemtic Name: 2-azanyl-5-(2,2-dimethylthian-4-yl)-4-sulfanyl-1H-pyrimidin-6-one Openeye Name: 2-amino-5-(2,2-dimethyltetrahydrothiopyran-4-yl)-4-sulfanyl-1H-pyrimidin-6-one CAS Name: 2-amino-5-(2,2-dimethyl-4-thianyl)-4-mercapto-1H-pyrimidin-6-one IUPAC Name: 2-amino-5-(2,2-dimethylthian-4-yl)-4-sulfanyl-1H-pyrimidin-6-one Traditional Name: 2-amino-5-(2,2-dimethyltetrahydrothiopyran-4-yl)-4-mercapto-1H-pyrimidin-6-one Formula: C11H17N3OS2 MolecularWeight: 271.40218

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCS1)C2=C(N=C(NC2=O)N)S)C

Isomeric SMILES

CC1(CC(CCS1)C2=C(N=C(NC2=O)N)S)C

InChI

InChI=1S/C11H17N3OS2/c1-11(2)5-6(3-4-17-11)7-8(15)13-10(12)14-9(7)16/h6H,3-5H2,1-2H3,(H4,12,13,14,15,16)