N-[2-(4-chlorophenyl)ethyl]-4-[3-(4-methoxyphenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-4-[3-(4-methoxyphenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-4-[3-(4-methoxyphenyl)sulfanyl-6-oxo-pyridazin-1-yl]benzamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-4-[3-[(4-methoxyphenyl)thio]-6-oxo-1-pyridazinyl]benzamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-4-[3-(4-methoxyphenyl)sulfanyl-6-oxopyridazin-1-yl]benzamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-4-[6-keto-3-[(4-methoxyphenyl)thio]pyridazin-1-yl]benzamide Formula: C26H22ClN3O3S MolecularWeight: 491.98918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=NN(C(=O)C=C2)C3=CC=C(C=C3)C(=O)NCCC4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)SC2=NN(C(=O)C=C2)C3=CC=C(C=C3)C(=O)NCCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H22ClN3O3S/c1-33-22-10-12-23(13-11-22)34-24-14-15-25(31)30(29-24)21-8-4-19(5-9-21)26(32)28-17-16-18-2-6-20(27)7-3-18/h2-15H,16-17H2,1H3,(H,28,32)