butyl-[(5-oxidanylidene-3-phenyl-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]azanium

Systemtic Name: butyl-[(5-oxidanylidene-3-phenyl-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]azanium Openeye Name: butyl-[(5-oxo-3-phenyl-thiazolo[3,2-a]pyrimidin-7-yl)methyl]ammonium CAS Name: butyl-[(5-oxo-3-phenyl-7-thiazolo[3,2-a]pyrimidinyl)methyl]ammonium IUPAC Name: butyl-[(5-oxo-3-phenyl-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]azanium Traditional Name: butyl-[(5-keto-3-phenyl-thiazolo[3,2-a]pyrimidin-7-yl)methyl]ammonium Formula: C17H20N3OS+ MolecularWeight: 314.4252

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]CC1=CC(=O)N2C(=CSC2=N1)C3=CC=CC=C3

Isomeric SMILES

CCCC[NH2+]CC1=CC(=O)N2C(=CSC2=N1)C3=CC=CC=C3

InChI

InChI=1S/C17H19N3OS/c1-2-3-9-18-11-14-10-16(21)20-15(12-22-17(20)19-14)13-7-5-4-6-8-13/h4-8,10,12,18H,2-3,9,11H2,1H3/p+1