2-(1-methylbenzimidazol-2-yl)sulfanyl-1-(1,2,5-trimethylpyrrol-3-yl)ethanone

Systemtic Name: 2-(1-methylbenzimidazol-2-yl)sulfanyl-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Openeye Name: 2-(1-methylbenzimidazol-2-yl)sulfanyl-1-(1,2,5-trimethylpyrrol-3-yl)ethanone CAS Name: 2-[(1-methyl-2-benzimidazolyl)thio]-1-(1,2,5-trimethyl-3-pyrrolyl)ethanone IUPAC Name: 2-(1-methylbenzimidazol-2-yl)sulfanyl-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Traditional Name: 2-[(1-methylbenzimidazol-2-yl)thio]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)CSC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)CSC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C17H19N3OS/c1-11-9-13(12(2)19(11)3)16(21)10-22-17-18-14-7-5-6-8-15(14)20(17)4/h5-9H,10H2,1-4H3