N-[4-[3-(2-azanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)propoxy]phenyl]-2-pyridin-1-ium-1-yl-ethanamide

Systemtic Name: N-[4-[3-(2-azanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)propoxy]phenyl]-2-pyridin-1-ium-1-yl-ethanamide Openeye Name: N-[4-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propoxy]phenyl]-2-pyridin-1-ium-1-yl-acetamide CAS Name: N-[4-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propoxy]phenyl]-2-(1-pyridin-1-iumyl)acetamide IUPAC Name: N-[4-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propoxy]phenyl]-2-pyridin-1-ium-1-ylacetamide Traditional Name: N-[4-[3-(2-amino-4-keto-6-methyl-1H-pyrimidin-5-yl)propoxy]phenyl]-2-pyridin-1-ium-1-yl-acetamide Formula: C21H24N5O3+ MolecularWeight: 394.44696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N)CCCOC2=CC=C(C=C2)NC(=O)C[N+]3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N)CCCOC2=CC=C(C=C2)NC(=O)C[N+]3=CC=CC=C3

InChI

InChI=1S/C21H23N5O3/c1-15-18(20(28)25-21(22)23-15)6-5-13-29-17-9-7-16(8-10-17)24-19(27)14-26-11-3-2-4-12-26/h2-4,7-12H,5-6,13-14H2,1H3,(H3-,22,23,24,25,27,28)/p+1