4-ethyl-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: 4-ethyl-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-1,2,3-thiadiazole-5-carboxamide Openeye Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-4-ethyl-thiadiazole-5-carboxamide CAS Name: 4-ethyl-N-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-5-thiadiazolecarboxamide IUPAC Name: N-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]-4-ethylthiadiazole-5-carboxamide Traditional Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-4-ethyl-thiadiazole-5-carboxamide Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SN=N1)C(=O)NCC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=C(SN=N1)C(=O)NCC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H21N5OS/c1-2-19-21(29-26-24-19)22(28)23-13-18-15-27(14-16-9-5-3-6-10-16)25-20(18)17-11-7-4-8-12-17/h3-12,15H,2,13-14H2,1H3,(H,23,28)