[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] (4E)-2-methyl-4-(phenylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] (4E)-2-methyl-4-(phenylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl] (4E)-4-benzylidene-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-2-methyl-4-(phenylmethylene)-2,3-dihydro-1H-acridine-9-carboxylic acid [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] (4E)-4-benzylidene-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-4-benzal-2-methyl-2,3-dihydro-1H-acridine-9-carboxylic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl] ester Formula: C29H23N3O3S MolecularWeight: 493.57622

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC2=CC=CC=C2)C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC(=O)NC5=C(C=CS5)C#N

Isomeric SMILES

CC1C/C(=C\C2=CC=CC=C2)/C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC(=O)NC5=C(C=CS5)C#N

InChI

InChI=1S/C29H23N3O3S/c1-18-13-21(15-19-7-3-2-4-8-19)27-23(14-18)26(22-9-5-6-10-24(22)31-27)29(34)35-17-25(33)32-28-20(16-30)11-12-36-28/h2-12,15,18H,13-14,17H2,1H3,(H,32,33)/b21-15+