tert-butyl N-[2-[(2S)-2-(methylcarbamoyl)pyrrolidin-1-yl]sulfonyl-3-phenyl-propyl]carbamate

Systemtic Name: tert-butyl N-[2-[(2S)-2-(methylcarbamoyl)pyrrolidin-1-yl]sulfonyl-3-phenyl-propyl]carbamate Openeye Name: tert-butyl N-[2-[(2S)-2-(methylcarbamoyl)pyrrolidin-1-yl]sulfonyl-3-phenyl-propyl]carbamate CAS Name: N-[2-[[(2S)-2-(methylcarbamoyl)-1-pyrrolidinyl]sulfonyl]-3-phenylpropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[(2S)-2-(methylcarbamoyl)pyrrolidin-1-yl]sulfonyl-3-phenylpropyl]carbamate Traditional Name: N-[2-[(2S)-2-(methylcarbamoyl)pyrrolidino]sulfonyl-3-phenyl-propyl]carbamic acid tert-butyl ester Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(CC1=CC=CC=C1)S(=O)(=O)N2CCCC2C(=O)NC

Isomeric SMILES

CC(C)(C)OC(=O)NCC(CC1=CC=CC=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NC

InChI

InChI=1S/C20H31N3O5S/c1-20(2,3)28-19(25)22-14-16(13-15-9-6-5-7-10-15)29(26,27)23-12-8-11-17(23)18(24)21-4/h5-7,9-10,16-17H,8,11-14H2,1-4H3,(H,21,24)(H,22,25)/t16?,17-/m0/s1