[4-(7-cyano-7-methyl-6-oxidanylidene-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-phenyl] methanesulfonate

Systemtic Name: [4-(7-cyano-7-methyl-6-oxidanylidene-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-phenyl] methanesulfonate Openeye Name: [4-(7-cyano-7-methyl-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-(7-cyano-7-methyl-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxyphenyl] ester IUPAC Name: [4-(7-cyano-7-methyl-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-(7-cyano-6-keto-7-methyl-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-phenyl] ester Formula: C19H16N4O5S MolecularWeight: 412.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC3=C(C=C2NC1=O)N=C(N3)C4=C(C=C(C=C4)OS(=O)(=O)C)OC)C#N

Isomeric SMILES

CC1(C2=CC3=C(C=C2NC1=O)N=C(N3)C4=C(C=C(C=C4)OS(=O)(=O)C)OC)C#N

InChI

InChI=1S/C19H16N4O5S/c1-19(9-20)12-7-14-15(8-13(12)23-18(19)24)22-17(21-14)11-5-4-10(6-16(11)27-2)28-29(3,25)26/h4-8H,1-3H3,(H,21,22)(H,23,24)