N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-1-benzyl-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-1-benzyl-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-1-benzyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C23H20N4O2S2 MolecularWeight: 448.5605

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C(=O)NC4=CC=CC=C4SCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C(=O)NC4=CC=CC=C4SCC(=O)N

InChI

InChI=1S/C23H20N4O2S2/c24-21(28)15-31-19-10-5-4-9-18(19)25-23(29)17-14-27(13-16-7-2-1-3-8-16)26-22(17)20-11-6-12-30-20/h1-12,14H,13,15H2,(H2,24,28)(H,25,29)