3-(1,2,4-triazol-1-yl)propyl 3-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: 3-(1,2,4-triazol-1-yl)propyl 3-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: 3-(1,2,4-triazol-1-yl)propyl 3-(thiophene-2-carbonylamino)benzoate CAS Name: 3-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid 3-(1,2,4-triazol-1-yl)propyl ester IUPAC Name: 3-(1,2,4-triazol-1-yl)propyl 3-(thiophene-2-carbonylamino)benzoate Traditional Name: 3-(2-thenoylamino)benzoic acid 3-(1,2,4-triazol-1-yl)propyl ester Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC=CS2)C(=O)OCCCN3C=NC=N3

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC=CS2)C(=O)OCCCN3C=NC=N3

InChI

InChI=1S/C17H16N4O3S/c22-16(15-6-2-9-25-15)20-14-5-1-4-13(10-14)17(23)24-8-3-7-21-12-18-11-19-21/h1-2,4-6,9-12H,3,7-8H2,(H,20,22)