(2S)-1-[4-chloranyl-3-(sulfinoamino)phenyl]sulfonyl-2-[[(2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-1-oxidanylidene-1-propan-2-yloxy-propan-2-yl]carbamoyl]pyrrolidine

Systemtic Name: (2S)-1-[4-chloranyl-3-(sulfinoamino)phenyl]sulfonyl-2-[[(2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-1-oxidanylidene-1-propan-2-yloxy-propan-2-yl]carbamoyl]pyrrolidine Openeye Name: (2S)-1-[4-chloro-3-(sulfinoamino)phenyl]sulfonyl-2-[[(1S)-1-[[4-(dimethylcarbamoyloxy)phenyl]methyl]-2-isopropoxy-2-oxo-ethyl]carbamoyl]pyrrolidine CAS Name: (2S)-1-[4-chloro-3-(sulfinoamino)phenyl]sulfonyl-2-[[[(2S)-3-[4-[dimethylamino(oxo)methoxy]phenyl]-1-oxo-1-propan-2-yloxypropan-2-yl]amino]-oxomethyl]pyrrolidine IUPAC Name: (2S)-1-[4-chloro-3-(sulfinoamino)phenyl]sulfonyl-2-[[(2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-1-oxo-1-propan-2-yloxypropan-2-yl]carbamoyl]pyrrolidine Traditional Name: (2S)-1-[4-chloro-3-(sulfinoamino)phenyl]sulfonyl-2-[[(1S)-1-[4-(dimethylcarbamoyloxy)benzyl]-2-isopropoxy-2-keto-ethyl]carbamoyl]pyrrolidine Formula: C26H33ClN4O9S2 MolecularWeight: 645.14462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CC1=CC=C(C=C1)OC(=O)N(C)C)NC(=O)C2CCCN2S(=O)(=O)C3=CC(=C(C=C3)Cl)NS(=O)O

Isomeric SMILES

CC(C)OC(=O)[C@H](CC1=CC=C(C=C1)OC(=O)N(C)C)NC(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC(=C(C=C3)Cl)NS(=O)O

InChI

InChI=1S/C26H33ClN4O9S2/c1-16(2)39-25(33)22(14-17-7-9-18(10-8-17)40-26(34)30(3)4)28-24(32)23-6-5-13-31(23)42(37,38)19-11-12-20(27)21(15-19)29-41(35)36/h7-12,15-16,22-23,29H,5-6,13-14H2,1-4H3,(H,28,32)(H,35,36)/t22-,23-/m0/s1