[4-tert-butyl-1-[(1-tert-butyl-5-chloranyl-6-oxidanylidene-pyridazin-4-yl)sulfanylmethyl]cyclohexyl] carbamate

Systemtic Name: [4-tert-butyl-1-[(1-tert-butyl-5-chloranyl-6-oxidanylidene-pyridazin-4-yl)sulfanylmethyl]cyclohexyl] carbamate Openeye Name: [4-tert-butyl-1-[(1-tert-butyl-5-chloro-6-oxo-pyridazin-4-yl)sulfanylmethyl]cyclohexyl] carbamate CAS Name: carbamic acid [4-tert-butyl-1-[[(1-tert-butyl-5-chloro-6-oxo-4-pyridazinyl)thio]methyl]cyclohexyl] ester IUPAC Name: [4-tert-butyl-1-[(1-tert-butyl-5-chloro-6-oxopyridazin-4-yl)sulfanylmethyl]cyclohexyl] carbamate Traditional Name: carbamic acid [4-tert-butyl-1-[[(1-tert-butyl-5-chloro-6-keto-pyridazin-4-yl)thio]methyl]cyclohexyl] ester Formula: C20H32ClN3O3S MolecularWeight: 430.00438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)(CSC2=C(C(=O)N(N=C2)C(C)(C)C)Cl)OC(=O)N

Isomeric SMILES

CC(C)(C)C1CCC(CC1)(CSC2=C(C(=O)N(N=C2)C(C)(C)C)Cl)OC(=O)N

InChI

InChI=1S/C20H32ClN3O3S/c1-18(2,3)13-7-9-20(10-8-13,27-17(22)26)12-28-14-11-23-24(19(4,5)6)16(25)15(14)21/h11,13H,7-10,12H2,1-6H3,(H2,22,26)