3-cyanopropyl (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: 3-cyanopropyl (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: 3-cyanopropyl (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 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl (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 3-cyanopropyl ester Formula: C23H20N2O2S MolecularWeight: 388.4821

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1C/C(=C\C2=CC=CS2)/C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCCCC#N

InChI

InChI=1S/C23H20N2O2S/c24-12-3-4-13-27-23(26)21-18-9-1-2-11-20(18)25-22-16(7-5-10-19(21)22)15-17-8-6-14-28-17/h1-2,6,8-9,11,14-15H,3-5,7,10,13H2/b16-15+