tert-butyl N-[(3R)-3-(4-fluorophenyl)-3-(4-methylsulfinylphenyl)propyl]carbamate

Systemtic Name: tert-butyl N-[(3R)-3-(4-fluorophenyl)-3-(4-methylsulfinylphenyl)propyl]carbamate Openeye Name: tert-butyl N-[(3R)-3-(4-fluorophenyl)-3-(4-methylsulfinylphenyl)propyl]carbamate CAS Name: N-[(3R)-3-(4-fluorophenyl)-3-(4-methylsulfinylphenyl)propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3R)-3-(4-fluorophenyl)-3-(4-methylsulfinylphenyl)propyl]carbamate Traditional Name: N-[(3R)-3-(4-fluorophenyl)-3-(4-methylsulfinylphenyl)propyl]carbamic acid tert-butyl ester Formula: C21H26FNO3S MolecularWeight: 391.499443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(C1=CC=C(C=C1)F)C2=CC=C(C=C2)S(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)NCC[C@H](C1=CC=C(C=C1)F)C2=CC=C(C=C2)S(=O)C

InChI

InChI=1S/C21H26FNO3S/c1-21(2,3)26-20(24)23-14-13-19(15-5-9-17(22)10-6-15)16-7-11-18(12-8-16)27(4)25/h5-12,19H,13-14H2,1-4H3,(H,23,24)/t19-,27?/m1/s1