N-[5-(4-ethylsulfanylphthalazin-1-yl)-2-methyl-phenyl]benzamide

Systemtic Name: N-[5-(4-ethylsulfanylphthalazin-1-yl)-2-methyl-phenyl]benzamide Openeye Name: N-[5-(4-ethylsulfanylphthalazin-1-yl)-2-methyl-phenyl]benzamide CAS Name: N-[5-[4-(ethylthio)-1-phthalazinyl]-2-methylphenyl]benzamide IUPAC Name: N-[5-(4-ethylsulfanylphthalazin-1-yl)-2-methylphenyl]benzamide Traditional Name: N-[5-[4-(ethylthio)phthalazin-1-yl]-2-methyl-phenyl]benzamide Formula: C24H21N3OS MolecularWeight: 399.50804

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(C2=CC=CC=C21)C3=CC(=C(C=C3)C)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCSC1=NN=C(C2=CC=CC=C21)C3=CC(=C(C=C3)C)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H21N3OS/c1-3-29-24-20-12-8-7-11-19(20)22(26-27-24)18-14-13-16(2)21(15-18)25-23(28)17-9-5-4-6-10-17/h4-15H,3H2,1-2H3,(H,25,28)