1-[4-(2-propan-2-yl-1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]sulfonylpiperidin-4-amine

Systemtic Name: 1-[4-(2-propan-2-yl-1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]sulfonylpiperidin-4-amine Openeye Name: 1-[4-(2-isopropyl-1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]sulfonylpiperidin-4-amine CAS Name: 1-[4-(2-propan-2-yl-1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]sulfonyl-4-piperidinamine IUPAC Name: 1-[4-(2-propan-2-yl-1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]sulfonylpiperidin-4-amine Traditional Name: [1-[4-(2-isopropyl-1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]sulfonyl-4-piperidyl]amine Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=CN=C2N1)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)N

Isomeric SMILES

CC(C)C1=CC2=C(C=CN=C2N1)C3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)N

InChI

InChI=1S/C21H26N4O2S/c1-14(2)20-13-19-18(7-10-23-21(19)24-20)15-3-5-17(6-4-15)28(26,27)25-11-8-16(22)9-12-25/h3-7,10,13-14,16H,8-9,11-12,22H2,1-2H3,(H,23,24)