1-adamantyl-[2,5-bis(azanyl)-4-methylsulfanyl-thieno[2,3-d]pyrimidin-6-yl]methanone

Systemtic Name: 1-adamantyl-[2,5-bis(azanyl)-4-methylsulfanyl-thieno[2,3-d]pyrimidin-6-yl]methanone Openeye Name: 1-adamantyl-(2,5-diamino-4-methylsulfanyl-thieno[2,3-d]pyrimidin-6-yl)methanone CAS Name: 1-adamantyl-[2,5-diamino-4-(methylthio)-6-thieno[2,3-d]pyrimidinyl]methanone IUPAC Name: 1-adamantyl-(2,5-diamino-4-methylsulfanylthieno[2,3-d]pyrimidin-6-yl)methanone Traditional Name: 1-adamantyl-[2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidin-6-yl]methanone Formula: C18H22N4OS2 MolecularWeight: 374.52348

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC2=C1C(=C(S2)C(=O)C34CC5CC(C3)CC(C5)C4)N)N

Isomeric SMILES

CSC1=NC(=NC2=C1C(=C(S2)C(=O)C34CC5CC(C3)CC(C5)C4)N)N

InChI

InChI=1S/C18H22N4OS2/c1-24-15-11-12(19)13(25-16(11)22-17(20)21-15)14(23)18-5-8-2-9(6-18)4-10(3-8)7-18/h8-10H,2-7,19H2,1H3,(H2,20,21,22)