8-methoxy-3-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]carbonyl-chromen-2-one

Systemtic Name: 8-methoxy-3-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 8-methoxy-3-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carbonyl]chromen-2-one CAS Name: 8-methoxy-3-[oxo-[4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 8-methoxy-3-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carbonyl]chromen-2-one Traditional Name: 8-methoxy-3-[4-(6-pyrrolidinopyrimidin-4-yl)piperazine-1-carbonyl]coumarin Formula: C23H25N5O4 MolecularWeight: 435.4757

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CCN(CC3)C4=NC=NC(=C4)N5CCCC5

Isomeric SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CCN(CC3)C4=NC=NC(=C4)N5CCCC5

InChI

InChI=1S/C23H25N5O4/c1-31-18-6-4-5-16-13-17(23(30)32-21(16)18)22(29)28-11-9-27(10-12-28)20-14-19(24-15-25-20)26-7-2-3-8-26/h4-6,13-15H,2-3,7-12H2,1H3