ethyl 2-[(2-bromophenyl)carbonylamino]-4-(1,2-dihydroacenaphthylen-5-yl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-bromophenyl)carbonylamino]-4-(1,2-dihydroacenaphthylen-5-yl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-bromobenzoyl)amino]-4-(1,2-dihydroacenaphthylen-5-yl)thiophene-3-carboxylate CAS Name: 2-[[(2-bromophenyl)-oxomethyl]amino]-4-(1,2-dihydroacenaphthylen-5-yl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-bromobenzoyl)amino]-4-(1,2-dihydroacenaphthylen-5-yl)thiophene-3-carboxylate Traditional Name: 4-acenaphthen-5-yl-2-[(2-bromobenzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C26H20BrNO3S MolecularWeight: 506.4109

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=C3C=CC=C4C3=C(CC4)C=C2)NC(=O)C5=CC=CC=C5Br

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=C3C=CC=C4C3=C(CC4)C=C2)NC(=O)C5=CC=CC=C5Br

InChI

InChI=1S/C26H20BrNO3S/c1-2-31-26(30)23-20(14-32-25(23)28-24(29)19-7-3-4-9-21(19)27)17-13-12-16-11-10-15-6-5-8-18(17)22(15)16/h3-9,12-14H,2,10-11H2,1H3,(H,28,29)