methyl 4-[3-(2-thiophen-2-ylethanoylamino)pyrazol-1-yl]butanoate

Systemtic Name: methyl 4-[3-(2-thiophen-2-ylethanoylamino)pyrazol-1-yl]butanoate Openeye Name: methyl 4-[3-[[2-(2-thienyl)acetyl]amino]pyrazol-1-yl]butanoate CAS Name: 4-[3-[(1-oxo-2-thiophen-2-ylethyl)amino]-1-pyrazolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[3-[(2-thiophen-2-ylacetyl)amino]pyrazol-1-yl]butanoate Traditional Name: 4-[3-[[2-(2-thienyl)acetyl]amino]pyrazol-1-yl]butyric acid methyl ester Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1C=CC(=N1)NC(=O)CC2=CC=CS2

Isomeric SMILES

COC(=O)CCCN1C=CC(=N1)NC(=O)CC2=CC=CS2

InChI

InChI=1S/C14H17N3O3S/c1-20-14(19)5-2-7-17-8-6-12(16-17)15-13(18)10-11-4-3-9-21-11/h3-4,6,8-9H,2,5,7,10H2,1H3,(H,15,16,18)