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

Systemtic Name: 8-ethoxy-3-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 8-ethoxy-3-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carbonyl]chromen-2-one CAS Name: 8-ethoxy-3-[oxo-[4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 8-ethoxy-3-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carbonyl]chromen-2-one Traditional Name: 8-ethoxy-3-[4-(6-pyrrolidinopyrimidin-4-yl)piperazine-1-carbonyl]coumarin Formula: C24H27N5O4 MolecularWeight: 449.50228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CCN(CC3)C4=NC=NC(=C4)N5CCCC5

Isomeric SMILES

CCOC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CCN(CC3)C4=NC=NC(=C4)N5CCCC5

InChI

InChI=1S/C24H27N5O4/c1-2-32-19-7-5-6-17-14-18(24(31)33-22(17)19)23(30)29-12-10-28(11-13-29)21-15-20(25-16-26-21)27-8-3-4-9-27/h5-7,14-16H,2-4,8-13H2,1H3