6-azanyl-2-[2-(3,4-dimethoxycyclohexyl)-2-oxidanylidene-ethyl]sulfanyl-5H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[2-(3,4-dimethoxycyclohexyl)-2-oxidanylidene-ethyl]sulfanyl-5H-pyrimidin-4-one Openeye Name: 6-amino-2-[2-(3,4-dimethoxycyclohexyl)-2-oxo-ethyl]sulfanyl-5H-pyrimidin-4-one CAS Name: 6-amino-2-[[2-(3,4-dimethoxycyclohexyl)-2-oxoethyl]thio]-5H-pyrimidin-4-one IUPAC Name: 6-amino-2-[2-(3,4-dimethoxycyclohexyl)-2-oxoethyl]sulfanyl-5H-pyrimidin-4-one Traditional Name: 6-amino-2-[[2-(3,4-dimethoxycyclohexyl)-2-keto-ethyl]thio]-5H-pyrimidin-4-one Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCC(CC1OC)C(=O)CSC2=NC(=O)CC(=N2)N

Isomeric SMILES

COC1CCC(CC1OC)C(=O)CSC2=NC(=O)CC(=N2)N

InChI

InChI=1S/C14H21N3O4S/c1-20-10-4-3-8(5-11(10)21-2)9(18)7-22-14-16-12(15)6-13(19)17-14/h8,10-11H,3-7H2,1-2H3,(H2,15,16,17,19)