[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanoate

Systemtic Name: [4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanoate Openeye Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 3-(3-methyl-2-oxo-benzimidazol-1-yl)propanoate CAS Name: 3-(3-methyl-2-oxo-1-benzimidazolyl)propanoic acid [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 3-(3-methyl-2-oxobenzimidazol-1-yl)propanoate Traditional Name: 3-(2-keto-3-methyl-benzimidazol-1-yl)propionic acid [4-amino-6-(dimethylamino)-s-triazin-2-yl]methyl ester Formula: C17H21N7O3 MolecularWeight: 371.39374

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCC(=O)OCC3=NC(=NC(=N3)N(C)C)N

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCC(=O)OCC3=NC(=NC(=N3)N(C)C)N

InChI

InChI=1S/C17H21N7O3/c1-22(2)16-20-13(19-15(18)21-16)10-27-14(25)8-9-24-12-7-5-4-6-11(12)23(3)17(24)26/h4-7H,8-10H2,1-3H3,(H2,18,19,20,21)