O1-tert-butyl O5-propan-2-yl 5-phenylsulfanyl-2H-pyrrole-1,5-dicarboxylate

Systemtic Name: O1-tert-butyl O5-propan-2-yl 5-phenylsulfanyl-2H-pyrrole-1,5-dicarboxylate Openeye Name: O1-tert-butyl O5-isopropyl 5-phenylsulfanyl-2H-pyrrole-1,5-dicarboxylate CAS Name: 5-(phenylthio)-2H-pyrrole-1,5-dicarboxylic acid O1-tert-butyl ester O5-propan-2-yl ester IUPAC Name: 1-O-tert-butyl 5-O-propan-2-yl 5-phenylsulfanyl-2H-pyrrole-1,5-dicarboxylate Traditional Name: 2-(phenylthio)-3-pyrroline-1,2-dicarboxylic acid O1-tert-butyl ester O2-isopropyl ester Formula: C19H25NO4S MolecularWeight: 363.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1(C=CCN1C(=O)OC(C)(C)C)SC2=CC=CC=C2

Isomeric SMILES

CC(C)OC(=O)C1(C=CCN1C(=O)OC(C)(C)C)SC2=CC=CC=C2

InChI

InChI=1S/C19H25NO4S/c1-14(2)23-16(21)19(25-15-10-7-6-8-11-15)12-9-13-20(19)17(22)24-18(3,4)5/h6-12,14H,13H2,1-5H3