N-[6-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butyl]sulfanylpyridazin-3-yl]ethanamide

Systemtic Name: N-[6-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butyl]sulfanylpyridazin-3-yl]ethanamide Openeye Name: N-[6-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]sulfanylpyridazin-3-yl]acetamide CAS Name: N-[6-[[4-oxo-4-(4-phenyl-1-piperazinyl)butyl]thio]-3-pyridazinyl]acetamide IUPAC Name: N-[6-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]sulfanylpyridazin-3-yl]acetamide Traditional Name: N-[6-[[4-keto-4-(4-phenylpiperazino)butyl]thio]pyridazin-3-yl]acetamide Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NN=C(C=C1)SCCCC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=NN=C(C=C1)SCCCC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H25N5O2S/c1-16(26)21-18-9-10-19(23-22-18)28-15-5-8-20(27)25-13-11-24(12-14-25)17-6-3-2-4-7-17/h2-4,6-7,9-10H,5,8,11-15H2,1H3,(H,21,22,26)