6-azanyl-5-[2-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-ium-1-yl]ethanoyl]-1-propyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-ium-1-yl]ethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[4-[(5-methylisoxazol-3-yl)methyl]piperazin-1-ium-1-yl]acetyl]-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[4-[(5-methyl-3-isoxazolyl)methyl]-1-piperazin-1-iumyl]-1-oxoethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-ium-1-yl]acetyl]-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[4-[(5-methylisoxazol-3-yl)methyl]piperazin-1-ium-1-yl]acetyl]-1-propyl-pyrimidine-2,4-quinone Formula: C18H27N6O4+ MolecularWeight: 391.44478

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+]2CCN(CC2)CC3=NOC(=C3)C)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+]2CCN(CC2)CC3=NOC(=C3)C)N

InChI

InChI=1S/C18H26N6O4/c1-3-4-24-16(19)15(17(26)20-18(24)27)14(25)11-23-7-5-22(6-8-23)10-13-9-12(2)28-21-13/h9H,3-8,10-11,19H2,1-2H3,(H,20,26,27)/p+1