ethyl 4-cyano-5-[(2-ethoxynaphthalen-1-yl)carbonylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[(2-ethoxynaphthalen-1-yl)carbonylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[(2-ethoxynaphthalene-1-carbonyl)amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[(2-ethoxy-1-naphthalenyl)-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[(2-ethoxynaphthalene-1-carbonyl)amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[(2-ethoxy-1-naphthoyl)amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NC3=C(C(=C(S3)C(=O)OCC)C)C#N

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NC3=C(C(=C(S3)C(=O)OCC)C)C#N

InChI

InChI=1S/C22H20N2O4S/c1-4-27-17-11-10-14-8-6-7-9-15(14)18(17)20(25)24-21-16(12-23)13(3)19(29-21)22(26)28-5-2/h6-11H,4-5H2,1-3H3,(H,24,25)