N5-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: N5-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: N5-[2-[(2-amino-2-oxoethyl)thio]phenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 5-N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-1-phenyl-2-pyrazoline-3,5-dicarboxamide Formula: C19H19N5O3S MolecularWeight: 397.45086

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C(=O)NC2=CC=CC=C2SCC(=O)N)C3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1C(N(N=C1C(=O)NC2=CC=CC=C2SCC(=O)N)C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C19H19N5O3S/c20-17(25)11-28-16-9-5-4-8-13(16)22-19(27)14-10-15(18(21)26)24(23-14)12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H2,20,25)(H2,21,26)(H,22,27)