1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-[(1-phenyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-(1-phenylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-[(1-phenylbenzimidazol-2-yl)thio]ethanone Formula: C24H25N3OS MolecularWeight: 403.5398

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)CSC2=NC3=CC=CC=C3N2C4=CC=CC=C4)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)CSC2=NC3=CC=CC=C3N2C4=CC=CC=C4)C

InChI

InChI=1S/C24H25N3OS/c1-4-14-26-17(2)15-20(18(26)3)23(28)16-29-24-25-21-12-8-9-13-22(21)27(24)19-10-6-5-7-11-19/h5-13,15H,4,14,16H2,1-3H3