2-[1-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]benzimidazol-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[1-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]benzimidazol-2-yl]sulfanylethanoic acid Openeye Name: 2-[1-[2-(cyclopropylamino)-2-oxo-ethyl]benzimidazol-2-yl]sulfanylacetic acid CAS Name: 2-[[1-[2-(cyclopropylamino)-2-oxoethyl]-2-benzimidazolyl]thio]acetic acid IUPAC Name: 2-[1-[2-(cyclopropylamino)-2-oxoethyl]benzimidazol-2-yl]sulfanylacetic acid Traditional Name: 2-[[1-[2-(cyclopropylamino)-2-keto-ethyl]benzimidazol-2-yl]thio]acetic acid Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CN2C3=CC=CC=C3N=C2SCC(=O)O

Isomeric SMILES

C1CC1NC(=O)CN2C3=CC=CC=C3N=C2SCC(=O)O

InChI

InChI=1S/C14H15N3O3S/c18-12(15-9-5-6-9)7-17-11-4-2-1-3-10(11)16-14(17)21-8-13(19)20/h1-4,9H,5-8H2,(H,15,18)(H,19,20)