methyl 1-cyclopropyl-2,5-dimethyl-4-[2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylethanoyl]pyrrole-3-carboxylate

Systemtic Name: methyl 1-cyclopropyl-2,5-dimethyl-4-[2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylethanoyl]pyrrole-3-carboxylate Openeye Name: methyl 1-cyclopropyl-2,5-dimethyl-4-[2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylacetyl]pyrrole-3-carboxylate CAS Name: 1-cyclopropyl-2,5-dimethyl-4-[2-[(1-methyl-5-phenyl-2-imidazolyl)thio]-1-oxoethyl]-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-cyclopropyl-2,5-dimethyl-4-[2-(1-methyl-5-phenylimidazol-2-yl)sulfanylacetyl]pyrrole-3-carboxylate Traditional Name: 1-cyclopropyl-2,5-dimethyl-4-[2-[(1-methyl-5-phenyl-imidazol-2-yl)thio]acetyl]pyrrole-3-carboxylic acid methyl ester Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C2CC2)C)C(=O)OC)C(=O)CSC3=NC=C(N3C)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(N1C2CC2)C)C(=O)OC)C(=O)CSC3=NC=C(N3C)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O3S/c1-14-20(21(22(28)29-4)15(2)26(14)17-10-11-17)19(27)13-30-23-24-12-18(25(23)3)16-8-6-5-7-9-16/h5-9,12,17H,10-11,13H2,1-4H3