[3-methoxy-4-(6-oxidanylidene-7-propan-2-yl-5,7-dihydro-1H-pyrrolo[2,3-f]benzimidazol-2-yl)phenyl] methanesulfonate

Systemtic Name: [3-methoxy-4-(6-oxidanylidene-7-propan-2-yl-5,7-dihydro-1H-pyrrolo[2,3-f]benzimidazol-2-yl)phenyl] methanesulfonate Openeye Name: [4-(7-isopropyl-6-oxo-5,7-dihydro-1H-pyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-methoxy-4-(6-oxo-7-propan-2-yl-5,7-dihydro-1H-pyrrolo[2,3-f]benzimidazol-2-yl)phenyl] ester IUPAC Name: [3-methoxy-4-(6-oxo-7-propan-2-yl-5,7-dihydro-1H-pyrrolo[2,3-f]benzimidazol-2-yl)phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-(7-isopropyl-6-keto-5,7-dihydro-1H-pyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-phenyl] ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C2=CC3=C(C=C2NC1=O)N=C(N3)C4=C(C=C(C=C4)OS(=O)(=O)C)OC

Isomeric SMILES

CC(C)C1C2=CC3=C(C=C2NC1=O)N=C(N3)C4=C(C=C(C=C4)OS(=O)(=O)C)OC

InChI

InChI=1S/C20H21N3O5S/c1-10(2)18-13-8-15-16(9-14(13)23-20(18)24)22-19(21-15)12-6-5-11(7-17(12)27-3)28-29(4,25)26/h5-10,18H,1-4H3,(H,21,22)(H,23,24)