1-adamantyl-[(5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]azanium

Systemtic Name: 1-adamantyl-[(5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]azanium Openeye Name: 1-adamantyl-[(5-oxothiazolo[3,2-a]pyrimidin-7-yl)methyl]ammonium CAS Name: 1-adamantyl-[(5-oxo-7-thiazolo[3,2-a]pyrimidinyl)methyl]ammonium IUPAC Name: 1-adamantyl-[(5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]azanium Traditional Name: 1-adamantyl-[(5-ketothiazolo[3,2-a]pyrimidin-7-yl)methyl]ammonium Formula: C17H22N3OS+ MolecularWeight: 316.44108

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=CC(=O)N5C=CSC5=N4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=CC(=O)N5C=CSC5=N4

InChI

InChI=1S/C17H21N3OS/c21-15-6-14(19-16-20(15)1-2-22-16)10-18-17-7-11-3-12(8-17)5-13(4-11)9-17/h1-2,6,11-13,18H,3-5,7-10H2/p+1