3-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)-5-thiophen-2-yl-pyrrol-2-yl]propanoate

Systemtic Name: 3-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)-5-thiophen-2-yl-pyrrol-2-yl]propanoate Openeye Name: 3-[1-(2-anilino-2-oxo-ethyl)-5-(2-thienyl)pyrrol-2-yl]propanoate CAS Name: 3-[1-(2-anilino-2-oxoethyl)-5-thiophen-2-yl-2-pyrrolyl]propanoate IUPAC Name: 3-[1-(2-anilino-2-oxoethyl)-5-thiophen-2-ylpyrrol-2-yl]propanoate Traditional Name: 3-[1-(2-anilino-2-keto-ethyl)-5-(2-thienyl)pyrrol-2-yl]propionate Formula: C19H17N2O3S- MolecularWeight: 353.41488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CN2C(=CC=C2C3=CC=CS3)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CN2C(=CC=C2C3=CC=CS3)CCC(=O)[O-]

InChI

InChI=1S/C19H18N2O3S/c22-18(20-14-5-2-1-3-6-14)13-21-15(9-11-19(23)24)8-10-16(21)17-7-4-12-25-17/h1-8,10,12H,9,11,13H2,(H,20,22)(H,23,24)/p-1