ethyl 2-[ethanoylcarbamoyl(2-methylpropyl)amino]-5-(naphthalen-1-ylmethyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[ethanoylcarbamoyl(2-methylpropyl)amino]-5-(naphthalen-1-ylmethyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[acetylcarbamoyl(isobutyl)amino]-5-(1-naphthylmethyl)thiophene-3-carboxylate CAS Name: 2-[[acetamido(oxo)methyl]-(2-methylpropyl)amino]-5-(1-naphthalenylmethyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[acetylcarbamoyl(2-methylpropyl)amino]-5-(naphthalen-1-ylmethyl)thiophene-3-carboxylate Traditional Name: 2-[acetylcarbamoyl(isobutyl)amino]-5-(1-naphthylmethyl)thiophene-3-carboxylic acid ethyl ester Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC3=CC=CC=C32)N(CC(C)C)C(=O)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC3=CC=CC=C32)N(CC(C)C)C(=O)NC(=O)C

InChI

InChI=1S/C25H28N2O4S/c1-5-31-24(29)22-14-20(13-19-11-8-10-18-9-6-7-12-21(18)19)32-23(22)27(15-16(2)3)25(30)26-17(4)28/h6-12,14,16H,5,13,15H2,1-4H3,(H,26,28,30)