[2-[(4-iodophenyl)amino]-2-oxidanylidene-ethyl] (4Z)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [2-[(4-iodophenyl)amino]-2-oxidanylidene-ethyl] (4Z)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [2-(4-iodoanilino)-2-oxo-ethyl] (4Z)-4-(2-thienylmethylene)-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4Z)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [2-(4-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-iodoanilino)-2-oxoethyl] (4Z)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4Z)-4-(2-thenylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [2-(4-iodoanilino)-2-keto-ethyl] ester Formula: C27H21IN2O3S MolecularWeight: 580.43671

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC=CS2)C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC(=O)NC5=CC=C(C=C5)I

Isomeric SMILES

C1C/C(=C/C2=CC=CS2)/C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC(=O)NC5=CC=C(C=C5)I

InChI

InChI=1S/C27H21IN2O3S/c28-18-10-12-19(13-11-18)29-24(31)16-33-27(32)25-21-7-1-2-9-23(21)30-26-17(5-3-8-22(25)26)15-20-6-4-14-34-20/h1-2,4,6-7,9-15H,3,5,8,16H2,(H,29,31)/b17-15-