3-[bis(thiophen-2-ylmethyl)amino]-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-[bis(thiophen-2-ylmethyl)amino]-1H-pyrazole-5-carboxylic acid Openeye Name: 3-[bis(2-thienylmethyl)amino]-1H-pyrazole-5-carboxylic acid CAS Name: 3-[bis(thiophen-2-ylmethyl)amino]-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-[bis(thiophen-2-ylmethyl)amino]-1H-pyrazole-5-carboxylic acid Traditional Name: 3-[bis(2-thenyl)amino]-1H-pyrazole-5-carboxylic acid Formula: C14H13N3O2S2 MolecularWeight: 319.40192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CN(CC2=CC=CS2)C3=NNC(=C3)C(=O)O

Isomeric SMILES

C1=CSC(=C1)CN(CC2=CC=CS2)C3=NNC(=C3)C(=O)O

InChI

InChI=1S/C14H13N3O2S2/c18-14(19)12-7-13(16-15-12)17(8-10-3-1-5-20-10)9-11-4-2-6-21-11/h1-7H,8-9H2,(H,15,16)(H,18,19)