ethyl 3-(4-methoxyphenyl)-5-(2-naphthalen-1-ylethanoylamino)-4-oxidanylidene-thieno[3,4-d]pyridazine-1-carboxylate

Systemtic Name: ethyl 3-(4-methoxyphenyl)-5-(2-naphthalen-1-ylethanoylamino)-4-oxidanylidene-thieno[3,4-d]pyridazine-1-carboxylate Openeye Name: ethyl 3-(4-methoxyphenyl)-5-[[2-(1-naphthyl)acetyl]amino]-4-oxo-thieno[3,4-d]pyridazine-1-carboxylate CAS Name: 3-(4-methoxyphenyl)-5-[[2-(1-naphthalenyl)-1-oxoethyl]amino]-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-methoxyphenyl)-5-[(2-naphthalen-1-ylacetyl)amino]-4-oxothieno[3,4-d]pyridazine-1-carboxylate Traditional Name: 4-keto-3-(4-methoxyphenyl)-5-[[2-(1-naphthyl)acetyl]amino]thieno[3,4-d]pyridazine-1-carboxylic acid ethyl ester Formula: C28H23N3O5S MolecularWeight: 513.56432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)CC3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)OC

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)CC3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)OC

InChI

InChI=1S/C28H23N3O5S/c1-3-36-28(34)25-22-16-37-26(24(22)27(33)31(30-25)19-11-13-20(35-2)14-12-19)29-23(32)15-18-9-6-8-17-7-4-5-10-21(17)18/h4-14,16H,3,15H2,1-2H3,(H,29,32)