N-methyl-5-oxidanylidene-N-[(1-phenylpyrazol-4-yl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide

Systemtic Name: N-methyl-5-oxidanylidene-N-[(1-phenylpyrazol-4-yl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: N-methyl-5-oxo-N-[(1-phenylpyrazol-4-yl)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: N-methyl-5-oxo-N-[(1-phenyl-4-pyrazolyl)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: N-methyl-5-oxo-N-[(1-phenylpyrazol-4-yl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: 5-keto-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C18H16N5O2S+ MolecularWeight: 366.41694

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=CNC4=[N+](C3=O)C=CS4

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=CNC4=[N+](C3=O)C=CS4

InChI

InChI=1S/C18H15N5O2S/c1-21(11-13-9-20-23(12-13)14-5-3-2-4-6-14)16(24)15-10-19-18-22(17(15)25)7-8-26-18/h2-10,12H,11H2,1H3/p+1