ethyl 4-[2-(5-naphthalen-2-yl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(5-naphthalen-2-yl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[5-(2-naphthyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[5-(2-naphthalenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(5-naphthalen-2-yl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-[4-keto-5-(2-naphthyl)thieno[2,3-d]pyrimidin-3-yl]acetyl]amino]benzoic acid ethyl ester Formula: C27H21N3O4S MolecularWeight: 483.53834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H21N3O4S/c1-2-34-27(33)18-9-11-21(12-10-18)29-23(31)14-30-16-28-25-24(26(30)32)22(15-35-25)20-8-7-17-5-3-4-6-19(17)13-20/h3-13,15-16H,2,14H2,1H3,(H,29,31)