N,N-diethyl-3-[2-(phenylmethyl)phenyl]sulfanyl-pyrazole-1-carboxamide

Systemtic Name: N,N-diethyl-3-[2-(phenylmethyl)phenyl]sulfanyl-pyrazole-1-carboxamide Openeye Name: 3-(2-benzylphenyl)sulfanyl-N,N-diethyl-pyrazole-1-carboxamide CAS Name: N,N-diethyl-3-[[2-(phenylmethyl)phenyl]thio]-1-pyrazolecarboxamide IUPAC Name: 3-(2-benzylphenyl)sulfanyl-N,N-diethylpyrazole-1-carboxamide Traditional Name: 3-[(2-benzylphenyl)thio]-N,N-diethyl-pyrazole-1-carboxamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1C=CC(=N1)SC2=CC=CC=C2CC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)N1C=CC(=N1)SC2=CC=CC=C2CC3=CC=CC=C3

InChI

InChI=1S/C21H23N3OS/c1-3-23(4-2)21(25)24-15-14-20(22-24)26-19-13-9-8-12-18(19)16-17-10-6-5-7-11-17/h5-15H,3-4,16H2,1-2H3