N-[(3-methoxyphenyl)methyl]-7-methyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-7-methyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Openeye Name: N-[(3-methoxyphenyl)methyl]-7-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide CAS Name: N-[(3-methoxyphenyl)methyl]-7-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-7-methyl-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Traditional Name: 5-keto-N-m-anisyl-7-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Formula: C15H16N3O4S2+ MolecularWeight: 366.43524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)[N+]2=C(N1)SC=C2)S(=O)(=O)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=C(C(=O)[N+]2=C(N1)SC=C2)S(=O)(=O)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C15H15N3O4S2/c1-10-13(14(19)18-6-7-23-15(18)17-10)24(20,21)16-9-11-4-3-5-12(8-11)22-2/h3-8,16H,9H2,1-2H3/p+1