ethyl 2-[(5-methoxy-5-oxidanylidene-pentanoyl)amino]-5-(phenylmethyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(5-methoxy-5-oxidanylidene-pentanoyl)amino]-5-(phenylmethyl)thiophene-3-carboxylate Openeye Name: ethyl 5-benzyl-2-[(5-methoxy-5-oxo-pentanoyl)amino]thiophene-3-carboxylate CAS Name: 2-[(5-methoxy-1,5-dioxopentyl)amino]-5-(phenylmethyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzyl-2-[(5-methoxy-5-oxopentanoyl)amino]thiophene-3-carboxylate Traditional Name: 5-benzyl-2-[(5-keto-5-methoxy-pentanoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=O)CCCC(=O)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=O)CCCC(=O)OC

InChI

InChI=1S/C20H23NO5S/c1-3-26-20(24)16-13-15(12-14-8-5-4-6-9-14)27-19(16)21-17(22)10-7-11-18(23)25-2/h4-6,8-9,13H,3,7,10-12H2,1-2H3,(H,21,22)