4-[(4-chloranylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)thiophene-2-carboxamide

Systemtic Name: 4-[(4-chloranylpyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)thiophene-2-carboxamide Openeye Name: 4-[(4-chloropyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)thiophene-2-carboxamide CAS Name: 4-[(4-chloro-1-pyrazolyl)methyl]-N-[2-(phenylthio)phenyl]-2-thiophenecarboxamide IUPAC Name: 4-[(4-chloropyrazol-1-yl)methyl]-N-(2-phenylsulfanylphenyl)thiophene-2-carboxamide Traditional Name: 4-[(4-chloropyrazol-1-yl)methyl]-N-[2-(phenylthio)phenyl]thiophene-2-carboxamide Formula: C21H16ClN3OS2 MolecularWeight: 425.95424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)C3=CC(=CS3)CN4C=C(C=N4)Cl

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)C3=CC(=CS3)CN4C=C(C=N4)Cl

InChI

InChI=1S/C21H16ClN3OS2/c22-16-11-23-25(13-16)12-15-10-20(27-14-15)21(26)24-18-8-4-5-9-19(18)28-17-6-2-1-3-7-17/h1-11,13-14H,12H2,(H,24,26)