2-(4-phenoxybutanoylamino)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: 2-(4-phenoxybutanoylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: 2-(4-phenoxybutanoylamino)-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[(1-oxo-4-phenoxybutyl)amino]-4-phenyl-3-thiophenecarboxylate IUPAC Name: 2-(4-phenoxybutanoylamino)-4-phenylthiophene-3-carboxylate Traditional Name: 2-(4-phenoxybutanoylamino)-4-phenyl-3-thenoate Formula: C21H18NO4S- MolecularWeight: 380.43692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=C2C(=O)[O-])NC(=O)CCCOC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=C2C(=O)[O-])NC(=O)CCCOC3=CC=CC=C3

InChI

InChI=1S/C21H19NO4S/c23-18(12-7-13-26-16-10-5-2-6-11-16)22-20-19(21(24)25)17(14-27-20)15-8-3-1-4-9-15/h1-6,8-11,14H,7,12-13H2,(H,22,23)(H,24,25)/p-1