2-chloranyl-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-5-methylsulfanyl-benzamide

Systemtic Name: 2-chloranyl-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-5-methylsulfanyl-benzamide Openeye Name: 2-chloro-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-5-methylsulfanyl-benzamide CAS Name: 2-chloro-N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]-5-(methylthio)benzamide IUPAC Name: 2-chloro-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-5-methylsulfanylbenzamide Traditional Name: 2-chloro-N-[2-(4-ethylbenzyl)pyrazol-3-yl]-5-(methylthio)benzamide Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=C(C=CC(=C3)SC)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=C(C=CC(=C3)SC)Cl

InChI

InChI=1S/C20H20ClN3OS/c1-3-14-4-6-15(7-5-14)13-24-19(10-11-22-24)23-20(25)17-12-16(26-2)8-9-18(17)21/h4-12H,3,13H2,1-2H3,(H,23,25)