ethyl 2-[(1H-benzimidazol-2-ylamino)-(2-hydroxyphenyl)methyl]sulfanylethanoate

Systemtic Name: ethyl 2-[(1H-benzimidazol-2-ylamino)-(2-hydroxyphenyl)methyl]sulfanylethanoate Openeye Name: ethyl 2-[(1H-benzimidazol-2-ylamino)-(2-hydroxyphenyl)methyl]sulfanylacetate CAS Name: 2-[[(1H-benzimidazol-2-ylamino)-(2-hydroxyphenyl)methyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1H-benzimidazol-2-ylamino)-(2-hydroxyphenyl)methyl]sulfanylacetate Traditional Name: 2-[[(1H-benzimidazol-2-ylamino)-(2-hydroxyphenyl)methyl]thio]acetic acid ethyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(C1=CC=CC=C1O)NC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)CSC(C1=CC=CC=C1O)NC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C18H19N3O3S/c1-2-24-16(23)11-25-17(12-7-3-6-10-15(12)22)21-18-19-13-8-4-5-9-14(13)20-18/h3-10,17,22H,2,11H2,1H3,(H2,19,20,21)