3-[4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]carbonylchromen-2-one

Systemtic Name: 3-[4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)piperazine-1-carbonyl]chromen-2-one CAS Name: 3-[[4-[2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[4-(2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carbonyl]chromen-2-one Traditional Name: 3-[4-(2-methyl-6-pyrrolidino-pyrimidin-4-yl)piperazine-1-carbonyl]coumarin Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4OC3=O)N5CCCC5

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4OC3=O)N5CCCC5

InChI

InChI=1S/C23H25N5O3/c1-16-24-20(26-8-4-5-9-26)15-21(25-16)27-10-12-28(13-11-27)22(29)18-14-17-6-2-3-7-19(17)31-23(18)30/h2-3,6-7,14-15H,4-5,8-13H2,1H3