3-[2-(4-ethylsulfonyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-5-methoxy-1H-pyrrolo[2,3-b]pyridine

Systemtic Name: 3-[2-(4-ethylsulfonyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-5-methoxy-1H-pyrrolo[2,3-b]pyridine Openeye Name: 3-[2-(4-ethylsulfonyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-5-methoxy-1H-pyrrolo[2,3-b]pyridine CAS Name: 3-[2-(4-ethylsulfonyl-1,4-diazepan-1-yl)-4-pyrimidinyl]-5-methoxy-1H-pyrrolo[2,3-b]pyridine IUPAC Name: 3-[2-(4-ethylsulfonyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-5-methoxy-1H-pyrrolo[2,3-b]pyridine Traditional Name: 3-[2-(4-esyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-5-methoxy-1H-pyrrolo[2,3-b]pyridine Formula: C19H24N6O3S MolecularWeight: 416.49726

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCCN(CC1)C2=NC=CC(=N2)C3=CNC4=NC=C(C=C34)OC

Isomeric SMILES

CCS(=O)(=O)N1CCCN(CC1)C2=NC=CC(=N2)C3=CNC4=NC=C(C=C34)OC

InChI

InChI=1S/C19H24N6O3S/c1-3-29(26,27)25-8-4-7-24(9-10-25)19-20-6-5-17(23-19)16-13-22-18-15(16)11-14(28-2)12-21-18/h5-6,11-13H,3-4,7-10H2,1-2H3,(H,21,22)