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

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] (2S,4E)-2-tert-butyl-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (2-oxo-2-ureido-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-(carbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(carbamoylamino)-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-keto-2-ureido-ethyl) ester Formula: C26H27N3O4S MolecularWeight: 477.57528

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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)NC(=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)NC(=O)N

InChI

InChI=1S/C26H27N3O4S/c1-26(2,3)16-11-15(12-17-7-6-10-34-17)23-19(13-16)22(18-8-4-5-9-20(18)28-23)24(31)33-14-21(30)29-25(27)32/h4-10,12,16H,11,13-14H2,1-3H3,(H3,27,29,30,32)/b15-12+/t16-/m0/s1