2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-5,6-dimethoxy-2,3-dihydroinden-1-one

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-5,6-dimethoxy-2,3-dihydroinden-1-one Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-5,6-dimethoxy-indan-1-one CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-5,6-dimethoxy-2,3-dihydroinden-1-one IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-5,6-dimethoxy-2,3-dihydroinden-1-one Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-5,6-dimethoxy-indan-1-one Formula: C15H16N4O3S MolecularWeight: 332.37754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)SC3=NC(=CC(=N3)N)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)SC3=NC(=CC(=N3)N)N)OC

InChI

InChI=1S/C15H16N4O3S/c1-21-9-3-7-4-11(14(20)8(7)5-10(9)22-2)23-15-18-12(16)6-13(17)19-15/h3,5-6,11H,4H2,1-2H3,(H4,16,17,18,19)