3-[4-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-5,6-dimethyl-pyridazine-4-carbonitrile

Systemtic Name: 3-[4-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-5,6-dimethyl-pyridazine-4-carbonitrile Openeye Name: 3-[4-[[5-(2-chlorophenyl)-2-thienyl]methyl]piperazin-1-yl]-5,6-dimethyl-pyridazine-4-carbonitrile CAS Name: 3-[4-[[5-(2-chlorophenyl)-2-thiophenyl]methyl]-1-piperazinyl]-5,6-dimethyl-4-pyridazinecarbonitrile IUPAC Name: 3-[4-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-5,6-dimethylpyridazine-4-carbonitrile Traditional Name: 3-[4-[[5-(2-chlorophenyl)-2-thienyl]methyl]piperazino]-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C22H22ClN5S MolecularWeight: 423.96158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN=C1C)N2CCN(CC2)CC3=CC=C(S3)C4=CC=CC=C4Cl)C#N

Isomeric SMILES

CC1=C(C(=NN=C1C)N2CCN(CC2)CC3=CC=C(S3)C4=CC=CC=C4Cl)C#N

InChI

InChI=1S/C22H22ClN5S/c1-15-16(2)25-26-22(19(15)13-24)28-11-9-27(10-12-28)14-17-7-8-21(29-17)18-5-3-4-6-20(18)23/h3-8H,9-12,14H2,1-2H3