5-[4-(thiophen-2-ylmethylamino)phenyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-[4-(thiophen-2-ylmethylamino)phenyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-[4-(2-thienylmethylamino)phenyl]-1,2-dihydropyrazol-3-one CAS Name: 5-[4-(thiophen-2-ylmethylamino)phenyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-[4-(thiophen-2-ylmethylamino)phenyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-[4-(2-thenylamino)phenyl]-3-pyrazolin-3-one Formula: C14H13N3OS MolecularWeight: 271.33752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CNC2=CC=C(C=C2)C3=CC(=O)NN3

Isomeric SMILES

C1=CSC(=C1)CNC2=CC=C(C=C2)C3=CC(=O)NN3

InChI

InChI=1S/C14H13N3OS/c18-14-8-13(16-17-14)10-3-5-11(6-4-10)15-9-12-2-1-7-19-12/h1-8,15H,9H2,(H2,16,17,18)