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1-methyl-5-[(1-propylbenzimidazol-2-yl)carbamoyl]pyrazole-4-carboxylic acid

1-methyl-5-[(1-propylbenzimidazol-2-yl)carbamoyl]pyrazole-4-carboxylic acid

Systemtic Name:1-methyl-5-[(1-propylbenzimidazol-2-yl)carbamoyl]pyrazole-4-carboxylic acid
Openeye Name:1-methyl-5-[(1-propylbenzimidazol-2-yl)carbamoyl]pyrazole-4-carboxylic acid
CAS Name:1-methyl-5-[oxo-[(1-propyl-2-benzimidazolyl)amino]methyl]-4-pyrazolecarboxylic acid
IUPAC Name:1-methyl-5-[(1-propylbenzimidazol-2-yl)carbamoyl]pyrazole-4-carboxylic acid
Traditional Name:1-methyl-5-[(1-propylbenzimidazol-2-yl)carbamoyl]pyrazole-4-carboxylic acid
Formula: C16H17N5O3
MolecularWeight: 327.33788
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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1NC(=O)C3=C(C=NN3C)C(=O)O


Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1NC(=O)C3=C(C=NN3C)C(=O)O


InChI

InChI=1S/C16H17N5O3/c1-3-8-21-12-7-5-4-6-11(12)18-16(21)19-14(22)13-10(15(23)24)9-17-20(13)2/h4-7,9H,3,8H2,1-2H3,(H,23,24)(H,18,19,22)


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