2-[4-[3-(1H-benzimidazol-2-ylamino)propyl]-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[3-(1H-benzimidazol-2-ylamino)propyl]-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]ethanoic acid Openeye Name: 2-[4-[3-(1H-benzimidazol-2-ylamino)propyl]-5-oxo-2-thioxo-imidazolidin-1-yl]acetic acid CAS Name: 2-[4-[3-(1H-benzimidazol-2-ylamino)propyl]-5-oxo-2-sulfanylidene-1-imidazolidinyl]acetic acid IUPAC Name: 2-[4-[3-(1H-benzimidazol-2-ylamino)propyl]-5-oxo-2-sulfanylideneimidazolidin-1-yl]acetic acid Traditional Name: 2-[4-[3-(1H-benzimidazol-2-ylamino)propyl]-5-keto-2-thioxo-imidazolidin-1-yl]acetic acid Formula: C15H17N5O3S MolecularWeight: 347.39218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)NCCCC3C(=O)N(C(=S)N3)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)NCCCC3C(=O)N(C(=S)N3)CC(=O)O

InChI

InChI=1S/C15H17N5O3S/c21-12(22)8-20-13(23)11(19-15(20)24)6-3-7-16-14-17-9-4-1-2-5-10(9)18-14/h1-2,4-5,11H,3,6-8H2,(H,19,24)(H,21,22)(H2,16,17,18)