[(2S)-1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [(2S)-1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [(1S)-2-(cyclopentylamino)-1-methyl-2-oxo-ethyl] (4E)-4-(2-thienylmethylene)-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-4-(2-thenylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [(1S)-2-(cyclopentylamino)-2-keto-1-methyl-ethyl] ester Formula: C27H28N2O3S MolecularWeight: 460.58782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)OC(=O)C2=C3CCCC(=CC4=CC=CS4)C3=NC5=CC=CC=C52

Isomeric SMILES

C[C@@H](C(=O)NC1CCCC1)OC(=O)C2=C3CCC/C(=C\C4=CC=CS4)/C3=NC5=CC=CC=C52

InChI

InChI=1S/C27H28N2O3S/c1-17(26(30)28-19-9-2-3-10-19)32-27(31)24-21-12-4-5-14-23(21)29-25-18(8-6-13-22(24)25)16-20-11-7-15-33-20/h4-5,7,11-12,14-17,19H,2-3,6,8-10,13H2,1H3,(H,28,30)/b18-16+/t17-/m0/s1