2-phenyl-N5-(3-phenylsulfanylpropyl)-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: 2-phenyl-N5-(3-phenylsulfanylpropyl)-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: 2-phenyl-N5-(3-phenylsulfanylpropyl)-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: 2-phenyl-N5-[3-(phenylthio)propyl]-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 2-phenyl-5-N-(3-phenylsulfanylpropyl)-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: 1-phenyl-N-[3-(phenylthio)propyl]-2-pyrazoline-3,5-dicarboxamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C(=O)NCCCSC2=CC=CC=C2)C3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1C(N(N=C1C(=O)NCCCSC2=CC=CC=C2)C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C20H22N4O2S/c21-19(25)18-14-17(23-24(18)15-8-3-1-4-9-15)20(26)22-12-7-13-27-16-10-5-2-6-11-16/h1-6,8-11,18H,7,12-14H2,(H2,21,25)(H,22,26)