3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]thio]acetic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]acetic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSCC(=O)OCCCN2C3=CC=CC=C3NC2=O

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CSCC(=O)OCCCN2C3=CC=CC=C3NC2=O

InChI

InChI=1S/C18H20N4O5S/c1-12-9-15(21-27-12)20-16(23)10-28-11-17(24)26-8-4-7-22-14-6-3-2-5-13(14)19-18(22)25/h2-3,5-6,9H,4,7-8,10-11H2,1H3,(H,19,25)(H,20,21,23)