4-[5-methyl-3-(1H-pyridin-4-ylidene)-1,2-oxazol-4-yl]-2-[3-oxidanyl-5-[3-(3-oxidanylpropylamino)propylamino]phenyl]imino-pyrimidin-5-one

Systemtic Name: 4-[5-methyl-3-(1H-pyridin-4-ylidene)-1,2-oxazol-4-yl]-2-[3-oxidanyl-5-[3-(3-oxidanylpropylamino)propylamino]phenyl]imino-pyrimidin-5-one Openeye Name: 2-[3-hydroxy-5-[3-(3-hydroxypropylamino)propylamino]phenyl]imino-4-[5-methyl-3-(1H-pyridin-4-ylidene)isoxazol-4-yl]pyrimidin-5-one CAS Name: 2-[3-hydroxy-5-[3-(3-hydroxypropylamino)propylamino]phenyl]imino-4-[5-methyl-3-(1H-pyridin-4-ylidene)-4-isoxazolyl]-5-pyrimidinone IUPAC Name: 2-[3-hydroxy-5-[3-(3-hydroxypropylamino)propylamino]phenyl]imino-4-[5-methyl-3-(1H-pyridin-4-ylidene)-1,2-oxazol-4-yl]pyrimidin-5-one Traditional Name: 2-[3-hydroxy-5-[3-(3-hydroxypropylamino)propylamino]phenyl]imino-4-[5-methyl-3-(1H-pyridin-4-ylidene)-4-isoxazolin-4-yl]pyrimidin-5-one Formula: C25H29N7O4 MolecularWeight: 491.54226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CNC=C2)NO1)C3=NC(=NC4=CC(=CC(=C4)O)NCCCNCCCO)N=CC3=O

Isomeric SMILES

CC1=C(C(=C2C=CNC=C2)NO1)C3=NC(=NC4=CC(=CC(=C4)O)NCCCNCCCO)N=CC3=O

InChI

InChI=1S/C25H29N7O4/c1-16-22(23(32-36-16)17-4-9-27-10-5-17)24-21(35)15-29-25(31-24)30-19-12-18(13-20(34)14-19)28-8-2-6-26-7-3-11-33/h4-5,9-10,12-15,26-28,32-34H,2-3,6-8,11H2,1H3