N5-[2-(4-chlorophenyl)sulfanylethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: N5-[2-(4-chlorophenyl)sulfanylethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-[2-(4-chlorophenyl)sulfanylethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: N5-[2-[(4-chlorophenyl)thio]ethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 5-N-[2-(4-chlorophenyl)sulfanylethyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-1-phenyl-2-pyrazoline-3,5-dicarboxamide Formula: C19H19ClN4O2S MolecularWeight: 402.89776

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C(=O)NCCSC2=CC=C(C=C2)Cl)C3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1C(N(N=C1C(=O)NCCSC2=CC=C(C=C2)Cl)C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C19H19ClN4O2S/c20-13-6-8-15(9-7-13)27-11-10-22-19(26)16-12-17(18(21)25)24(23-16)14-4-2-1-3-5-14/h1-9,17H,10-12H2,(H2,21,25)(H,22,26)