2-[5-azanyl-6-(methylamino)pyrimidin-4-yl]sulfanyl-3-methoxy-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 2-[5-azanyl-6-(methylamino)pyrimidin-4-yl]sulfanyl-3-methoxy-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 2-[5-amino-6-(methylamino)pyrimidin-4-yl]sulfanyl-3-methoxy-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 2-[[5-amino-6-(methylamino)-4-pyrimidinyl]thio]-3-methoxy-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 2-[5-amino-6-(methylamino)pyrimidin-4-yl]sulfanyl-3-methoxy-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 2-[[5-amino-6-(methylamino)pyrimidin-4-yl]thio]-3-methoxy-5,5-dimethyl-cyclohex-2-en-1-one Formula: C14H20N4O2S MolecularWeight: 308.3992

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)SC2=NC=NC(=C2N)NC)OC)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)SC2=NC=NC(=C2N)NC)OC)C

InChI

InChI=1S/C14H20N4O2S/c1-14(2)5-8(19)11(9(6-14)20-4)21-13-10(15)12(16-3)17-7-18-13/h7H,5-6,15H2,1-4H3,(H,16,17,18)