ethyl 4-(4-methoxyphenyl)-2-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-2-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-2-[(4-oxo-3-propyl-phthalazine-1-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-[[oxo-(4-oxo-3-propyl-1-phthalazinyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-2-[(4-oxo-3-propylphthalazine-1-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 2-[(4-keto-3-propyl-phthalazine-1-carbonyl)amino]-4-(4-methoxyphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)OC)C(=O)OCC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)OC)C(=O)OCC

InChI

InChI=1S/C26H25N3O5S/c1-4-14-29-25(31)19-9-7-6-8-18(19)22(28-29)23(30)27-24-21(26(32)34-5-2)20(15-35-24)16-10-12-17(33-3)13-11-16/h6-13,15H,4-5,14H2,1-3H3,(H,27,30)