methyl 4-[2-methyl-4-(2-sulfanylidenepyrrolidin-1-yl)phenyl]benzoate

Systemtic Name: methyl 4-[2-methyl-4-(2-sulfanylidenepyrrolidin-1-yl)phenyl]benzoate Openeye Name: methyl 4-[2-methyl-4-(2-thioxopyrrolidin-1-yl)phenyl]benzoate CAS Name: 4-[2-methyl-4-(2-sulfanylidene-1-pyrrolidinyl)phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-methyl-4-(2-sulfanylidenepyrrolidin-1-yl)phenyl]benzoate Traditional Name: 4-[2-methyl-4-(2-thioxopyrrolidino)phenyl]benzoic acid methyl ester Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2=S)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2=S)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H19NO2S/c1-13-12-16(20-11-3-4-18(20)23)9-10-17(13)14-5-7-15(8-6-14)19(21)22-2/h5-10,12H,3-4,11H2,1-2H3