[1-[(4-butan-2-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-tert-butyl-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [1-[(4-butan-2-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-tert-butyl-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [1-methyl-2-oxo-2-(4-sec-butylanilino)ethyl] 2-tert-butyl-4-(2-thienylmethylene)-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: 2-tert-butyl-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [1-(4-butan-2-ylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-butan-2-ylanilino)-1-oxopropan-2-yl] 2-tert-butyl-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: 2-tert-butyl-4-(2-thenylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [2-keto-1-methyl-2-(4-sec-butylanilino)ethyl] ester Formula: C36H40N2O3S MolecularWeight: 580.7794

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C(C)OC(=O)C2=C3CC(CC(=CC4=CC=CS4)C3=NC5=CC=CC=C52)C(C)(C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C(C)OC(=O)C2=C3CC(CC(=CC4=CC=CS4)C3=NC5=CC=CC=C52)C(C)(C)C

InChI

InChI=1S/C36H40N2O3S/c1-7-22(2)24-14-16-27(17-15-24)37-34(39)23(3)41-35(40)32-29-12-8-9-13-31(29)38-33-25(20-28-11-10-18-42-28)19-26(21-30(32)33)36(4,5)6/h8-18,20,22-23,26H,7,19,21H2,1-6H3,(H,37,39)