ethyl 3-[[5-oxidanylidene-1-phenyl-4-(phenylmethyl)-4H-imidazol-2-yl]amino]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-[[5-oxidanylidene-1-phenyl-4-(phenylmethyl)-4H-imidazol-2-yl]amino]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[(4-benzyl-5-oxo-1-phenyl-4H-imidazol-2-yl)amino]benzothiophene-2-carboxylate CAS Name: 3-[[5-oxo-1-phenyl-4-(phenylmethyl)-4H-imidazol-2-yl]amino]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-benzyl-5-oxo-1-phenyl-4H-imidazol-2-yl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[(4-benzyl-5-keto-1-phenyl-2-imidazolin-2-yl)amino]benzothiophene-2-carboxylic acid ethyl ester Formula: C27H23N3O3S MolecularWeight: 469.55482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2S1)NC3=NC(C(=O)N3C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2S1)NC3=NC(C(=O)N3C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C27H23N3O3S/c1-2-33-26(32)24-23(20-15-9-10-16-22(20)34-24)29-27-28-21(17-18-11-5-3-6-12-18)25(31)30(27)19-13-7-4-8-14-19/h3-16,21H,2,17H2,1H3,(H,28,29)