(4-pyrazol-1-ylphenyl)methyl 3-(thiophen-3-ylcarbonylamino)propanoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 3-(thiophen-3-ylcarbonylamino)propanoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 3-(thiophene-3-carbonylamino)propanoate CAS Name: 3-[[oxo(3-thiophenyl)methyl]amino]propanoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 3-(thiophene-3-carbonylamino)propanoate Traditional Name: 3-(3-thenoylamino)propionic acid (4-pyrazol-1-ylbenzyl) ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)COC(=O)CCNC(=O)C3=CSC=C3

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)COC(=O)CCNC(=O)C3=CSC=C3

InChI

InChI=1S/C18H17N3O3S/c22-17(6-9-19-18(23)15-7-11-25-13-15)24-12-14-2-4-16(5-3-14)21-10-1-8-20-21/h1-5,7-8,10-11,13H,6,9,12H2,(H,19,23)