4-(3-methylphenyl)-6-phenylsulfanyl-3-piperazin-1-yl-pyridazine

Systemtic Name: 4-(3-methylphenyl)-6-phenylsulfanyl-3-piperazin-1-yl-pyridazine Openeye Name: 4-(m-tolyl)-6-phenylsulfanyl-3-piperazin-1-yl-pyridazine CAS Name: 4-(3-methylphenyl)-6-(phenylthio)-3-(1-piperazinyl)pyridazine IUPAC Name: 4-(3-methylphenyl)-6-phenylsulfanyl-3-piperazin-1-ylpyridazine Traditional Name: 4-(m-tolyl)-6-(phenylthio)-3-piperazino-pyridazine Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC(=NN=C2N3CCNCC3)SC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC(=NN=C2N3CCNCC3)SC4=CC=CC=C4

InChI

InChI=1S/C21H22N4S/c1-16-6-5-7-17(14-16)19-15-20(26-18-8-3-2-4-9-18)23-24-21(19)25-12-10-22-11-13-25/h2-9,14-15,22H,10-13H2,1H3