N-(3,4-dimethylphenyl)-3-[(6-phenylpyridazin-3-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(3,4-dimethylphenyl)-3-[(6-phenylpyridazin-3-yl)sulfanylmethyl]benzamide Openeye Name: N-(3,4-dimethylphenyl)-3-[(6-phenylpyridazin-3-yl)sulfanylmethyl]benzamide CAS Name: N-(3,4-dimethylphenyl)-3-[[(6-phenyl-3-pyridazinyl)thio]methyl]benzamide IUPAC Name: N-(3,4-dimethylphenyl)-3-[(6-phenylpyridazin-3-yl)sulfanylmethyl]benzamide Traditional Name: N-(3,4-dimethylphenyl)-3-[[(6-phenylpyridazin-3-yl)thio]methyl]benzamide Formula: C26H23N3OS MolecularWeight: 425.54532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)CSC3=NN=C(C=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)CSC3=NN=C(C=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C26H23N3OS/c1-18-11-12-23(15-19(18)2)27-26(30)22-10-6-7-20(16-22)17-31-25-14-13-24(28-29-25)21-8-4-3-5-9-21/h3-16H,17H2,1-2H3,(H,27,30)