methyl 3-[[1-[3-(1-oxidanylidene-1,4-thiazinan-4-yl)propyl]benzimidazol-2-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-[[1-[3-(1-oxidanylidene-1,4-thiazinan-4-yl)propyl]benzimidazol-2-yl]carbonylamino]propanoate Openeye Name: methyl 3-[[1-[3-(1-oxo-1,4-thiazinan-4-yl)propyl]benzimidazole-2-carbonyl]amino]propanoate CAS Name: 3-[[oxo-[1-[3-(1-oxo-1,4-thiazinan-4-yl)propyl]-2-benzimidazolyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[1-[3-(1-oxo-1,4-thiazinan-4-yl)propyl]benzimidazole-2-carbonyl]amino]propanoate Traditional Name: 3-[[1-[3-(1-keto-1,4-thiazinan-4-yl)propyl]benzimidazole-2-carbonyl]amino]propionic acid methyl ester Formula: C19H26N4O4S MolecularWeight: 406.49914

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)C1=NC2=CC=CC=C2N1CCCN3CCS(=O)CC3

Isomeric SMILES

COC(=O)CCNC(=O)C1=NC2=CC=CC=C2N1CCCN3CCS(=O)CC3

InChI

InChI=1S/C19H26N4O4S/c1-27-17(24)7-8-20-19(25)18-21-15-5-2-3-6-16(15)23(18)10-4-9-22-11-13-28(26)14-12-22/h2-3,5-6H,4,7-14H2,1H3,(H,20,25)