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

Systemtic Name: methyl 5-[2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanylethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanylacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[[1-(4-methoxyphenyl)-2-imidazolyl]thio]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanylacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[[1-(4-methoxyphenyl)imidazol-2-yl]thio]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)CSC2=NC=CN2C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)CSC2=NC=CN2C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21N3O4S/c1-12-17(19(25)27-4)13(2)22-18(12)16(24)11-28-20-21-9-10-23(20)14-5-7-15(26-3)8-6-14/h5-10,22H,11H2,1-4H3