4-methyl-7-(3-piperidin-4-ylpyrrolo[3,2-b]pyridin-1-yl)sulfonyl-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 4-methyl-7-(3-piperidin-4-ylpyrrolo[3,2-b]pyridin-1-yl)sulfonyl-2,3-dihydro-1,4-benzoxazine Openeye Name: 4-methyl-7-[3-(4-piperidyl)pyrrolo[3,2-b]pyridin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazine CAS Name: 4-methyl-7-[[3-(4-piperidinyl)-1-pyrrolo[3,2-b]pyridinyl]sulfonyl]-2,3-dihydro-1,4-benzoxazine IUPAC Name: 4-methyl-7-(3-piperidin-4-ylpyrrolo[3,2-b]pyridin-1-yl)sulfonyl-2,3-dihydro-1,4-benzoxazine Traditional Name: 4-methyl-7-[3-(4-piperidyl)pyrrolo[3,2-b]pyridin-1-yl]sulfonyl-2,3-dihydro-1,4-benzoxazine Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCOC2=C1C=CC(=C2)S(=O)(=O)N3C=C(C4=C3C=CC=N4)C5CCNCC5

Isomeric SMILES

CN1CCOC2=C1C=CC(=C2)S(=O)(=O)N3C=C(C4=C3C=CC=N4)C5CCNCC5

InChI

InChI=1S/C21H24N4O3S/c1-24-11-12-28-20-13-16(4-5-18(20)24)29(26,27)25-14-17(15-6-9-22-10-7-15)21-19(25)3-2-8-23-21/h2-5,8,13-15,22H,6-7,9-12H2,1H3