1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanone CAS Name: 1-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-[[1-(4-methoxyphenyl)-2-imidazolyl]thio]ethanone IUPAC Name: 1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanylethanone Traditional Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[[1-(4-methoxyphenyl)imidazol-2-yl]thio]ethanone Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)CSC3=NC=CN3C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)CSC3=NC=CN3C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H23N3O2S/c1-14-12-19(15(2)24(14)17-4-5-17)20(25)13-27-21-22-10-11-23(21)16-6-8-18(26-3)9-7-16/h6-12,17H,4-5,13H2,1-3H3