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

Systemtic Name: N-cyclopropyl-3-(4-methylphenyl)-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: N-cyclopropyl-5-oxo-3-(p-tolyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: N-cyclopropyl-3-(4-methylphenyl)-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: N-cyclopropyl-3-(4-methylphenyl)-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: N-cyclopropyl-5-keto-3-(p-tolyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C17H16N3O2S+ MolecularWeight: 326.39284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=[N+]2C(=O)C(=CN3)C(=O)NC4CC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=[N+]2C(=O)C(=CN3)C(=O)NC4CC4

InChI

InChI=1S/C17H15N3O2S/c1-10-2-4-11(5-3-10)14-9-23-17-18-8-13(16(22)20(14)17)15(21)19-12-6-7-12/h2-5,8-9,12H,6-7H2,1H3,(H,19,21)/p+1