methyl 3-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-(2-thienyl)propanoate CAS Name: 3-[[3-(1H-benzimidazol-2-yl)-1-oxopropyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-(2-thienyl)propionic acid methyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)CCC2=NC3=CC=CC=C3N2

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC(=O)CCC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C18H19N3O3S/c1-24-18(23)11-14(15-7-4-10-25-15)21-17(22)9-8-16-19-12-5-2-3-6-13(12)20-16/h2-7,10,14H,8-9,11H2,1H3,(H,19,20)(H,21,22)