methyl 4-anthracen-1-yl-2-phenylazanyl-5-(phenylcarbonyl)thiophene-3-carboxylate

Systemtic Name: methyl 4-anthracen-1-yl-2-phenylazanyl-5-(phenylcarbonyl)thiophene-3-carboxylate Openeye Name: methyl 2-anilino-4-(1-anthryl)-5-benzoyl-thiophene-3-carboxylate CAS Name: 2-anilino-4-(1-anthracenyl)-5-benzoyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-anilino-4-anthracen-1-yl-5-benzoylthiophene-3-carboxylate Traditional Name: 2-anilino-4-(1-anthryl)-5-benzoyl-thiophene-3-carboxylic acid methyl ester Formula: C33H23NO3S MolecularWeight: 513.60562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1C2=CC=CC3=CC4=CC=CC=C4C=C32)C(=O)C5=CC=CC=C5)NC6=CC=CC=C6

Isomeric SMILES

COC(=O)C1=C(SC(=C1C2=CC=CC3=CC4=CC=CC=C4C=C32)C(=O)C5=CC=CC=C5)NC6=CC=CC=C6

InChI

InChI=1S/C33H23NO3S/c1-37-33(36)29-28(26-18-10-15-24-19-22-13-8-9-14-23(22)20-27(24)26)31(30(35)21-11-4-2-5-12-21)38-32(29)34-25-16-6-3-7-17-25/h2-20,34H,1H3