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

Systemtic Name: methyl 4-[2-(3-cyanopyridin-2-yl)sulfanylethanoyl]-1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: methyl 4-[2-[(3-cyano-2-pyridyl)sulfanyl]acetyl]-1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 4-[2-[(3-cyano-2-pyridinyl)thio]-1-oxoethyl]-1-cyclopropyl-2,5-dimethyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(3-cyanopyridin-2-yl)sulfanylacetyl]-1-cyclopropyl-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 4-[2-[(3-cyano-2-pyridyl)thio]acetyl]-1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylic acid methyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C2CC2)C)C(=O)OC)C(=O)CSC3=C(C=CC=N3)C#N

Isomeric SMILES

CC1=C(C(=C(N1C2CC2)C)C(=O)OC)C(=O)CSC3=C(C=CC=N3)C#N

InChI

InChI=1S/C19H19N3O3S/c1-11-16(15(23)10-26-18-13(9-20)5-4-8-21-18)17(19(24)25-3)12(2)22(11)14-6-7-14/h4-5,8,14H,6-7,10H2,1-3H3