[5-[(4-methoxyphenyl)sulfonylmethyl]furan-2-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [5-[(4-methoxyphenyl)sulfonylmethyl]furan-2-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [5-[(4-methoxyphenyl)sulfonylmethyl]-2-furyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [5-[(4-methoxyphenyl)sulfonylmethyl]-2-furanyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [5-[(4-methoxyphenyl)sulfonylmethyl]furan-2-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [5-[(4-methoxyphenyl)sulfonylmethyl]-2-furyl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(O2)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(O2)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H22N4O5S/c1-29-16-3-6-18(7-4-16)31(27,28)15-17-5-8-19(30-17)20(26)24-11-13-25(14-12-24)21-22-9-2-10-23-21/h2-10H,11-15H2,1H3