7-[(1-azanyl-2,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]-2,3-dimethyl-benzimidazole-5-carboxylic acid

Systemtic Name: 7-[(1-azanyl-2,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]-2,3-dimethyl-benzimidazole-5-carboxylic acid Openeye Name: 7-[(1-carbamoyl-1,2-dimethyl-propyl)carbamoyl]-2,3-dimethyl-benzimidazole-5-carboxylic acid CAS Name: 7-[[(1-amino-2,3-dimethyl-1-oxobutan-2-yl)amino]-oxomethyl]-2,3-dimethyl-5-benzimidazolecarboxylic acid IUPAC Name: 7-[(1-amino-2,3-dimethyl-1-oxobutan-2-yl)carbamoyl]-2,3-dimethylbenzimidazole-5-carboxylic acid Traditional Name: 7-[(1-carbamoyl-1,2-dimethyl-propyl)carbamoyl]-2,3-dimethyl-benzimidazole-5-carboxylic acid Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2N1C)C(=O)O)C(=O)NC(C)(C(C)C)C(=O)N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2N1C)C(=O)O)C(=O)NC(C)(C(C)C)C(=O)N

InChI

InChI=1S/C17H22N4O4/c1-8(2)17(4,16(18)25)20-14(22)11-6-10(15(23)24)7-12-13(11)19-9(3)21(12)5/h6-8H,1-5H3,(H2,18,25)(H,20,22)(H,23,24)