methyl 5-(4-chlorophenyl)-3-(pentanoylamino)thiophene-2-carboxylate

Systemtic Name: methyl 5-(4-chlorophenyl)-3-(pentanoylamino)thiophene-2-carboxylate Openeye Name: methyl 5-(4-chlorophenyl)-3-(pentanoylamino)thiophene-2-carboxylate CAS Name: 5-(4-chlorophenyl)-3-(1-oxopentylamino)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-chlorophenyl)-3-(pentanoylamino)thiophene-2-carboxylate Traditional Name: 5-(4-chlorophenyl)-3-(valerylamino)thiophene-2-carboxylic acid methyl ester Formula: C17H18ClNO3S MolecularWeight: 351.84772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(SC(=C1)C2=CC=C(C=C2)Cl)C(=O)OC

Isomeric SMILES

CCCCC(=O)NC1=C(SC(=C1)C2=CC=C(C=C2)Cl)C(=O)OC

InChI

InChI=1S/C17H18ClNO3S/c1-3-4-5-15(20)19-13-10-14(23-16(13)17(21)22-2)11-6-8-12(18)9-7-11/h6-10H,3-5H2,1-2H3,(H,19,20)