7,7-dimethyl-2-(4-methylsulfanylphenyl)-5-propyl-1H-pyrrolo[2,3-f]benzimidazol-6-one

Systemtic Name: 7,7-dimethyl-2-(4-methylsulfanylphenyl)-5-propyl-1H-pyrrolo[2,3-f]benzimidazol-6-one Openeye Name: 7,7-dimethyl-2-(4-methylsulfanylphenyl)-5-propyl-1H-pyrrolo[2,3-f]benzimidazol-6-one CAS Name: 7,7-dimethyl-2-[4-(methylthio)phenyl]-5-propyl-1H-pyrrolo[2,3-f]benzimidazol-6-one IUPAC Name: 7,7-dimethyl-2-(4-methylsulfanylphenyl)-5-propyl-1H-pyrrolo[2,3-f]benzimidazol-6-one Traditional Name: 7,7-dimethyl-2-[4-(methylthio)phenyl]-5-propyl-1H-pyrrolo[2,3-f]benzimidazol-6-one Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC3=C(C=C2C(C1=O)(C)C)NC(=N3)C4=CC=C(C=C4)SC

Isomeric SMILES

CCCN1C2=CC3=C(C=C2C(C1=O)(C)C)NC(=N3)C4=CC=C(C=C4)SC

InChI

InChI=1S/C21H23N3OS/c1-5-10-24-18-12-17-16(11-15(18)21(2,3)20(24)25)22-19(23-17)13-6-8-14(26-4)9-7-13/h6-9,11-12H,5,10H2,1-4H3,(H,22,23)