(2-azanyl-2-oxidanylidene-ethyl) (2S,4E)-2-tert-butyl-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) (2S,4E)-2-tert-butyl-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) (2S,4E)-2-tert-butyl-4-(2-thienylmethylene)-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (2S,4E)-2-tert-butyl-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) (2S,4E)-2-tert-butyl-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (2S,4E)-2-tert-butyl-4-(2-thenylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid (2-amino-2-keto-ethyl) ester Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC(=CC2=CC=CS2)C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC(=O)N

Isomeric SMILES

CC(C)(C)[C@H]1C/C(=C\C2=CC=CS2)/C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC(=O)N

InChI

InChI=1S/C25H26N2O3S/c1-25(2,3)16-11-15(12-17-7-6-10-31-17)23-19(13-16)22(24(29)30-14-21(26)28)18-8-4-5-9-20(18)27-23/h4-10,12,16H,11,13-14H2,1-3H3,(H2,26,28)/b15-12+/t16-/m0/s1