(2-oxidanylidene-2-phenylazanyl-ethyl) 2-(1-propylbenzimidazol-2-yl)sulfanylethanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-(1-propylbenzimidazol-2-yl)sulfanylethanoate Openeye Name: (2-anilino-2-oxo-ethyl) 2-(1-propylbenzimidazol-2-yl)sulfanylacetate CAS Name: 2-[(1-propyl-2-benzimidazolyl)thio]acetic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 2-(1-propylbenzimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-propylbenzimidazol-2-yl)thio]acetic acid (2-anilino-2-keto-ethyl) ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1SCC(=O)OCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1SCC(=O)OCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O3S/c1-2-12-23-17-11-7-6-10-16(17)22-20(23)27-14-19(25)26-13-18(24)21-15-8-4-3-5-9-15/h3-11H,2,12-14H2,1H3,(H,21,24)