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

Systemtic Name: 4-[3-(4-methylphenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]-N-[2-(4-methylpiperazin-1-yl)ethyl]benzamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-4-[6-oxo-3-(p-tolylsulfanyl)pyridazin-1-yl]benzamide CAS Name: 4-[3-[(4-methylphenyl)thio]-6-oxo-1-pyridazinyl]-N-[2-(4-methyl-1-piperazinyl)ethyl]benzamide IUPAC Name: 4-[3-(4-methylphenyl)sulfanyl-6-oxopyridazin-1-yl]-N-[2-(4-methylpiperazin-1-yl)ethyl]benzamide Traditional Name: 4-[6-keto-3-(p-tolylthio)pyridazin-1-yl]-N-[2-(4-methylpiperazino)ethyl]benzamide Formula: C25H29N5O2S MolecularWeight: 463.59506

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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)NCCN4CCN(CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NN(C(=O)C=C2)C3=CC=C(C=C3)C(=O)NCCN4CCN(CC4)C

InChI

InChI=1S/C25H29N5O2S/c1-19-3-9-22(10-4-19)33-23-11-12-24(31)30(27-23)21-7-5-20(6-8-21)25(32)26-13-14-29-17-15-28(2)16-18-29/h3-12H,13-18H2,1-2H3,(H,26,32)