N,5-bis(4-chlorophenyl)-4-(2-ethylsulfanylethyl)-4-methyl-3H-pyrazole-2-carboxamide

Systemtic Name: N,5-bis(4-chlorophenyl)-4-(2-ethylsulfanylethyl)-4-methyl-3H-pyrazole-2-carboxamide Openeye Name: N,5-bis(4-chlorophenyl)-4-(2-ethylsulfanylethyl)-4-methyl-3H-pyrazole-2-carboxamide CAS Name: N,5-bis(4-chlorophenyl)-4-[2-(ethylthio)ethyl]-4-methyl-3H-pyrazole-2-carboxamide IUPAC Name: N,5-bis(4-chlorophenyl)-4-(2-ethylsulfanylethyl)-4-methyl-3H-pyrazole-2-carboxamide Traditional Name: N,3-bis(4-chlorophenyl)-4-[2-(ethylthio)ethyl]-4-methyl-2-pyrazoline-1-carboxamide Formula: C21H23Cl2N3OS MolecularWeight: 436.39782

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCSCCC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H23Cl2N3OS/c1-3-28-13-12-21(2)14-26(20(27)24-18-10-8-17(23)9-11-18)25-19(21)15-4-6-16(22)7-5-15/h4-11H,3,12-14H2,1-2H3,(H,24,27)