1-oxidanidyl-N-[1-[4-oxidanylidene-3-(phenylmethyl)pyrido[2,3-d]pyrimidin-2-yl]propyl]-N-propyl-pyridin-1-ium-4-carboxamide

Systemtic Name: 1-oxidanidyl-N-[1-[4-oxidanylidene-3-(phenylmethyl)pyrido[2,3-d]pyrimidin-2-yl]propyl]-N-propyl-pyridin-1-ium-4-carboxamide Openeye Name: N-[1-(3-benzyl-4-oxo-pyrido[2,3-d]pyrimidin-2-yl)propyl]-1-oxido-N-propyl-pyridin-1-ium-4-carboxamide CAS Name: 1-oxido-N-[1-[4-oxo-3-(phenylmethyl)-2-pyrido[2,3-d]pyrimidinyl]propyl]-N-propyl-4-pyridin-1-iumcarboxamide IUPAC Name: N-[1-(3-benzyl-4-oxopyrido[2,3-d]pyrimidin-2-yl)propyl]-1-oxido-N-propylpyridin-1-ium-4-carboxamide Traditional Name: N-[1-(3-benzyl-4-keto-pyrido[2,3-d]pyrimidin-2-yl)propyl]-1-oxido-N-propyl-pyridin-1-ium-4-carboxamide Formula: C26H27N5O3 MolecularWeight: 457.52428

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(CC)C1=NC2=C(C=CC=N2)C(=O)N1CC3=CC=CC=C3)C(=O)C4=CC=[N+](C=C4)[O-]

Isomeric SMILES

CCCN(C(CC)C1=NC2=C(C=CC=N2)C(=O)N1CC3=CC=CC=C3)C(=O)C4=CC=[N+](C=C4)[O-]

InChI

InChI=1S/C26H27N5O3/c1-3-15-30(25(32)20-12-16-29(34)17-13-20)22(4-2)24-28-23-21(11-8-14-27-23)26(33)31(24)18-19-9-6-5-7-10-19/h5-14,16-17,22H,3-4,15,18H2,1-2H3