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4-[(5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methylamino]benzenecarbonitrile
4-[(5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methylamino]benzenecarbonitrile
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC(=CC=C1C#N)NCC2=CC(=O)[N+]3=C(N2)SC=C3
Isomeric SMILES
C1=CC(=CC=C1C#N)NCC2=CC(=O)[N+]3=C(N2)SC=C3
InChI
InChI=1S/C14H10N4OS/c15-8-10-1-3-11(4-2-10)16-9-12-7-13(19)18-5-6-20-14(18)17-12/h1-7,16H,9H2/p+1
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