methyl 4-ethylsulfanyl-2-[(4-methoxyphenyl)methyl]-2,5-dihydropyrrole-1-carboxylate

Systemtic Name: methyl 4-ethylsulfanyl-2-[(4-methoxyphenyl)methyl]-2,5-dihydropyrrole-1-carboxylate Openeye Name: methyl 4-ethylsulfanyl-2-[(4-methoxyphenyl)methyl]-2,5-dihydropyrrole-1-carboxylate CAS Name: 4-(ethylthio)-2-[(4-methoxyphenyl)methyl]-2,5-dihydropyrrole-1-carboxylic acid methyl ester IUPAC Name: methyl 4-ethylsulfanyl-2-[(4-methoxyphenyl)methyl]-2,5-dihydropyrrole-1-carboxylate Traditional Name: 4-(ethylthio)-2-p-anisyl-3-pyrroline-1-carboxylic acid methyl ester Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC(N(C1)C(=O)OC)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCSC1=CC(N(C1)C(=O)OC)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H21NO3S/c1-4-21-15-10-13(17(11-15)16(18)20-3)9-12-5-7-14(19-2)8-6-12/h5-8,10,13H,4,9,11H2,1-3H3