1-(cyclopropylmethyl)-2-[(propan-2-ylcarbamoylamino)methyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-(cyclopropylmethyl)-2-[(propan-2-ylcarbamoylamino)methyl]benzimidazole-5-carboxylic acid Openeye Name: 1-(cyclopropylmethyl)-2-[(isopropylcarbamoylamino)methyl]benzimidazole-5-carboxylic acid CAS Name: 1-(cyclopropylmethyl)-2-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-(cyclopropylmethyl)-2-[(propan-2-ylcarbamoylamino)methyl]benzimidazole-5-carboxylic acid Traditional Name: 1-(cyclopropylmethyl)-2-[(isopropylcarbamoylamino)methyl]benzimidazole-5-carboxylic acid Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=NC2=C(N1CC3CC3)C=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)NC(=O)NCC1=NC2=C(N1CC3CC3)C=CC(=C2)C(=O)O

InChI

InChI=1S/C17H22N4O3/c1-10(2)19-17(24)18-8-15-20-13-7-12(16(22)23)5-6-14(13)21(15)9-11-3-4-11/h5-7,10-11H,3-4,8-9H2,1-2H3,(H,22,23)(H2,18,19,24)