7-[6-(4-methylpiperazin-1-yl)pyrrolo[2,3-b]pyridin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 7-[6-(4-methylpiperazin-1-yl)pyrrolo[2,3-b]pyridin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Openeye Name: 7-[6-(4-methylpiperazin-1-yl)pyrrolo[2,3-b]pyridin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one CAS Name: 7-[[6-(4-methyl-1-piperazinyl)-1-pyrrolo[2,3-b]pyridinyl]sulfonyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 7-[6-(4-methylpiperazin-1-yl)pyrrolo[2,3-b]pyridin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Traditional Name: 7-[6-(4-methylpiperazino)pyrrolo[2,3-b]pyridin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Formula: C20H21N5O4S MolecularWeight: 427.47684

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=C(C=C2)C=CN3S(=O)(=O)C4=CC5=C(C=C4)NC(=O)CO5

Isomeric SMILES

CN1CCN(CC1)C2=NC3=C(C=C2)C=CN3S(=O)(=O)C4=CC5=C(C=C4)NC(=O)CO5

InChI

InChI=1S/C20H21N5O4S/c1-23-8-10-24(11-9-23)18-5-2-14-6-7-25(20(14)22-18)30(27,28)15-3-4-16-17(12-15)29-13-19(26)21-16/h2-7,12H,8-11,13H2,1H3,(H,21,26)