N-(8-methyl-4-oxidanylidene-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-yl)benzamide

Systemtic Name: N-(8-methyl-4-oxidanylidene-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-yl)benzamide Openeye Name: N-(8-methyl-4-oxo-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-yl)benzamide CAS Name: N-(8-methyl-4-oxo-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-yl)benzamide IUPAC Name: N-(8-methyl-4-oxo-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-yl)benzamide Traditional Name: N-(4-keto-8-methyl-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-yl)benzamide Formula: C18H14N3O2S+ MolecularWeight: 336.38766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[N+]3=C(S2)NC=C(C3=O)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)[N+]3=C(S2)NC=C(C3=O)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C18H13N3O2S/c1-11-7-8-14-15(9-11)24-18-19-10-13(17(23)21(14)18)20-16(22)12-5-3-2-4-6-12/h2-10H,1H3,(H,20,22)/p+1