4-methyl-7-[6-(4-methylpiperazin-1-yl)pyrrolo[2,3-b]pyridin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 4-methyl-7-[6-(4-methylpiperazin-1-yl)pyrrolo[2,3-b]pyridin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazine Openeye Name: 4-methyl-7-[6-(4-methylpiperazin-1-yl)pyrrolo[2,3-b]pyridin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazine CAS Name: 4-methyl-7-[[6-(4-methyl-1-piperazinyl)-1-pyrrolo[2,3-b]pyridinyl]sulfonyl]-2,3-dihydro-1,4-benzoxazine IUPAC Name: 4-methyl-7-[6-(4-methylpiperazin-1-yl)pyrrolo[2,3-b]pyridin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazine Traditional Name: 4-methyl-7-[6-(4-methylpiperazino)pyrrolo[2,3-b]pyridin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazine Formula: C21H25N5O3S MolecularWeight: 427.5199

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=C(C=C2)C=CN3S(=O)(=O)C4=CC5=C(C=C4)N(CCO5)C

Isomeric SMILES

CN1CCN(CC1)C2=NC3=C(C=C2)C=CN3S(=O)(=O)C4=CC5=C(C=C4)N(CCO5)C

InChI

InChI=1S/C21H25N5O3S/c1-23-9-11-25(12-10-23)20-6-3-16-7-8-26(21(16)22-20)30(27,28)17-4-5-18-19(15-17)29-14-13-24(18)2/h3-8,15H,9-14H2,1-2H3