6-(3,5-dimethylpyrazol-1-yl)-2-[(4-phenethylpiperidin-1-yl)methyl]pyridazine-3-thione

Systemtic Name: 6-(3,5-dimethylpyrazol-1-yl)-2-[(4-phenethylpiperidin-1-yl)methyl]pyridazine-3-thione Openeye Name: 6-(3,5-dimethylpyrazol-1-yl)-2-[(4-phenethyl-1-piperidyl)methyl]pyridazine-3-thione CAS Name: 6-(3,5-dimethyl-1-pyrazolyl)-2-[(4-phenethyl-1-piperidinyl)methyl]-3-pyridazinethione IUPAC Name: 6-(3,5-dimethylpyrazol-1-yl)-2-[(4-phenethylpiperidin-1-yl)methyl]pyridazine-3-thione Traditional Name: 6-(3,5-dimethylpyrazol-1-yl)-2-[(4-phenethylpiperidino)methyl]pyridazine-3-thione Formula: C23H29N5S MolecularWeight: 407.57486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN(C(=S)C=C2)CN3CCC(CC3)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN1C2=NN(C(=S)C=C2)CN3CCC(CC3)CCC4=CC=CC=C4)C

InChI

InChI=1S/C23H29N5S/c1-18-16-19(2)28(24-18)22-10-11-23(29)27(25-22)17-26-14-12-21(13-15-26)9-8-20-6-4-3-5-7-20/h3-7,10-11,16,21H,8-9,12-15,17H2,1-2H3