N-[6-[4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]pyridazin-3-yl]benzamide

Systemtic Name: N-[6-[4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]pyridazin-3-yl]benzamide Openeye Name: N-[6-[4-[2-(2-thienyl)acetyl]piperazin-1-yl]pyridazin-3-yl]benzamide CAS Name: N-[6-[4-(1-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]-3-pyridazinyl]benzamide IUPAC Name: N-[6-[4-(2-thiophen-2-ylacetyl)piperazin-1-yl]pyridazin-3-yl]benzamide Traditional Name: N-[6-[4-[2-(2-thienyl)acetyl]piperazino]pyridazin-3-yl]benzamide Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)NC(=O)C3=CC=CC=C3)C(=O)CC4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)NC(=O)C3=CC=CC=C3)C(=O)CC4=CC=CS4

InChI

InChI=1S/C21H21N5O2S/c27-20(15-17-7-4-14-29-17)26-12-10-25(11-13-26)19-9-8-18(23-24-19)22-21(28)16-5-2-1-3-6-16/h1-9,14H,10-13,15H2,(H,22,23,28)