1-[4-(1,3-dimethyl-3-pyridin-3-yl-2H-indol-2-yl)but-3-ynyl]-1-oxidanyl-urea

Systemtic Name: 1-[4-(1,3-dimethyl-3-pyridin-3-yl-2H-indol-2-yl)but-3-ynyl]-1-oxidanyl-urea Openeye Name: 1-[4-[1,3-dimethyl-3-(3-pyridyl)indolin-2-yl]but-3-ynyl]-1-hydroxy-urea CAS Name: 1-[4-[1,3-dimethyl-3-(3-pyridinyl)-2H-indol-2-yl]but-3-ynyl]-1-hydroxyurea IUPAC Name: 1-[4-(1,3-dimethyl-3-pyridin-3-yl-2H-indol-2-yl)but-3-ynyl]-1-hydroxyurea Traditional Name: 1-[4-[1,3-dimethyl-3-(3-pyridyl)indolin-2-yl]but-3-ynyl]-1-hydroxy-urea Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(C2=CC=CC=C21)C)C#CCCN(C(=O)N)O)C3=CN=CC=C3

Isomeric SMILES

CC1(C(N(C2=CC=CC=C21)C)C#CCCN(C(=O)N)O)C3=CN=CC=C3

InChI

InChI=1S/C20H22N4O2/c1-20(15-8-7-12-22-14-15)16-9-3-4-10-17(16)23(2)18(20)11-5-6-13-24(26)19(21)25/h3-4,7-10,12,14,18,26H,6,13H2,1-2H3,(H2,21,25)