tert-butyl 4,4-dimethyl-5-phenylsulfanyl-2,3-dihydropyrrole-2-carboxylate

Systemtic Name: tert-butyl 4,4-dimethyl-5-phenylsulfanyl-2,3-dihydropyrrole-2-carboxylate Openeye Name: tert-butyl 4,4-dimethyl-5-phenylsulfanyl-2,3-dihydropyrrole-2-carboxylate CAS Name: 4,4-dimethyl-5-(phenylthio)-2,3-dihydropyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4,4-dimethyl-5-phenylsulfanyl-2,3-dihydropyrrole-2-carboxylate Traditional Name: 4,4-dimethyl-5-(phenylthio)-1-pyrroline-2-carboxylic acid tert-butyl ester Formula: C17H23NO2S MolecularWeight: 305.43502

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(N=C1SC2=CC=CC=C2)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1(CC(N=C1SC2=CC=CC=C2)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C17H23NO2S/c1-16(2,3)20-14(19)13-11-17(4,5)15(18-13)21-12-9-7-6-8-10-12/h6-10,13H,11H2,1-5H3