2-(4-chlorophenyl)-2-[6-[4-(phenylmethyl)piperidin-1-yl]pyridazin-3-yl]ethanethioamide

Systemtic Name: 2-(4-chlorophenyl)-2-[6-[4-(phenylmethyl)piperidin-1-yl]pyridazin-3-yl]ethanethioamide Openeye Name: 2-[6-(4-benzyl-1-piperidyl)pyridazin-3-yl]-2-(4-chlorophenyl)thioacetamide CAS Name: 2-(4-chlorophenyl)-2-[6-[4-(phenylmethyl)-1-piperidinyl]-3-pyridazinyl]ethanethioamide IUPAC Name: 2-[6-(4-benzylpiperidin-1-yl)pyridazin-3-yl]-2-(4-chlorophenyl)ethanethioamide Traditional Name: 2-[6-(4-benzylpiperidino)pyridazin-3-yl]-2-(4-chlorophenyl)thioacetamide Formula: C24H25ClN4S MolecularWeight: 437.0001

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=NN=C(C=C3)C(C4=CC=C(C=C4)Cl)C(=S)N

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=NN=C(C=C3)C(C4=CC=C(C=C4)Cl)C(=S)N

InChI

InChI=1S/C24H25ClN4S/c25-20-8-6-19(7-9-20)23(24(26)30)21-10-11-22(28-27-21)29-14-12-18(13-15-29)16-17-4-2-1-3-5-17/h1-11,18,23H,12-16H2,(H2,26,30)