N-cyclopentyl-4-[3-(4-methylphenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide

Systemtic Name: N-cyclopentyl-4-[3-(4-methylphenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide Openeye Name: N-cyclopentyl-4-[6-oxo-3-(p-tolylsulfanyl)pyridazin-1-yl]benzamide CAS Name: N-cyclopentyl-4-[3-[(4-methylphenyl)thio]-6-oxo-1-pyridazinyl]benzamide IUPAC Name: N-cyclopentyl-4-[3-(4-methylphenyl)sulfanyl-6-oxopyridazin-1-yl]benzamide Traditional Name: N-cyclopentyl-4-[6-keto-3-(p-tolylthio)pyridazin-1-yl]benzamide Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NN(C(=O)C=C2)C3=CC=C(C=C3)C(=O)NC4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NN(C(=O)C=C2)C3=CC=C(C=C3)C(=O)NC4CCCC4

InChI

InChI=1S/C23H23N3O2S/c1-16-6-12-20(13-7-16)29-21-14-15-22(27)26(25-21)19-10-8-17(9-11-19)23(28)24-18-4-2-3-5-18/h6-15,18H,2-5H2,1H3,(H,24,28)