N-phenyl-3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidin-5-ium-1-carbothioamide

Systemtic Name: N-phenyl-3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidin-5-ium-1-carbothioamide Openeye Name: N-phenyl-3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidin-5-ium-1-carbothioamide CAS Name: N-phenyl-3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidin-5-ium-1-carbothioamide IUPAC Name: N-phenyl-3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidin-5-ium-1-carbothioamide Traditional Name: N-phenyl-3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidin-5-ium-1-carbothioamide Formula: C14H19N4S+ MolecularWeight: 275.39246

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=[N+](C1)CCCN2C(=S)NC3=CC=CC=C3

Isomeric SMILES

C1CNC2=[N+](C1)CCCN2C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C14H18N4S/c19-14(16-12-6-2-1-3-7-12)18-11-5-10-17-9-4-8-15-13(17)18/h1-3,6-7H,4-5,8-11H2,(H,16,19)/p+1