N-tert-butyl-4-[3-(4-chlorophenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide

Systemtic Name: N-tert-butyl-4-[3-(4-chlorophenyl)sulfanyl-6-oxidanylidene-pyridazin-1-yl]benzamide Openeye Name: N-tert-butyl-4-[3-(4-chlorophenyl)sulfanyl-6-oxo-pyridazin-1-yl]benzamide CAS Name: N-tert-butyl-4-[3-[(4-chlorophenyl)thio]-6-oxo-1-pyridazinyl]benzamide IUPAC Name: N-tert-butyl-4-[3-(4-chlorophenyl)sulfanyl-6-oxopyridazin-1-yl]benzamide Traditional Name: N-tert-butyl-4-[3-[(4-chlorophenyl)thio]-6-keto-pyridazin-1-yl]benzamide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)N2C(=O)C=CC(=N2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)N2C(=O)C=CC(=N2)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20ClN3O2S/c1-21(2,3)23-20(27)14-4-8-16(9-5-14)25-19(26)13-12-18(24-25)28-17-10-6-15(22)7-11-17/h4-13H,1-3H3,(H,23,27)