O1-tert-butyl O2-(2-sulfanylidenepyridin-1-yl) (2R,3S)-3-[(3-methanoyl-6-methoxycarbonyl-4-phenylmethoxy-indol-1-yl)methyl]aziridine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-(2-sulfanylidenepyridin-1-yl) (2R,3S)-3-[(3-methanoyl-6-methoxycarbonyl-4-phenylmethoxy-indol-1-yl)methyl]aziridine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-(2-thioxo-1-pyridyl) (2R,3S)-3-[(4-benzyloxy-3-formyl-6-methoxycarbonyl-indol-1-yl)methyl]aziridine-1,2-dicarboxylate CAS Name: (2R,3S)-3-[(3-formyl-6-methoxycarbonyl-4-phenylmethoxy-1-indolyl)methyl]aziridine-1,2-dicarboxylic acid O1-tert-butyl ester O2-(2-sulfanylidene-1-pyridinyl) ester IUPAC Name: 1-O-tert-butyl 2-O-(2-sulfanylidenepyridin-1-yl) (2R,3S)-3-[(3-formyl-6-methoxycarbonyl-4-phenylmethoxyindol-1-yl)methyl]aziridine-1,2-dicarboxylate Traditional Name: (2R,3S)-3-[(4-benzoxy-6-carbomethoxy-3-formyl-indol-1-yl)methyl]ethylenimine-1,2-dicarboxylic acid O1-tert-butyl ester O2-(2-thioxo-1-pyridyl) ester Formula: C32H31N3O8S MolecularWeight: 617.66884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(C1C(=O)ON2C=CC=CC2=S)CN3C=C(C4=C3C=C(C=C4OCC5=CC=CC=C5)C(=O)OC)C=O

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@H]([C@@H]1C(=O)ON2C=CC=CC2=S)CN3C=C(C4=C3C=C(C=C4OCC5=CC=CC=C5)C(=O)OC)C=O

InChI

InChI=1S/C32H31N3O8S/c1-32(2,3)42-31(39)35-24(28(35)30(38)43-34-13-9-8-12-26(34)44)17-33-16-22(18-36)27-23(33)14-21(29(37)40-4)15-25(27)41-19-20-10-6-5-7-11-20/h5-16,18,24,28H,17,19H2,1-4H3/t24-,28+,35?/m0/s1