[3-(4-chloranylbutanoylamino)-3-methyl-2-oxidanylidene-butyl] thiocyanate

Systemtic Name: [3-(4-chloranylbutanoylamino)-3-methyl-2-oxidanylidene-butyl] thiocyanate Openeye Name: [3-(4-chlorobutanoylamino)-3-methyl-2-oxo-butyl] thiocyanate CAS Name: thiocyanic acid [3-[(4-chloro-1-oxobutyl)amino]-3-methyl-2-oxobutyl] ester IUPAC Name: [3-(4-chlorobutanoylamino)-3-methyl-2-oxobutyl] thiocyanate Traditional Name: thiocyanic acid [3-(4-chlorobutanoylamino)-2-keto-3-methyl-butyl] ester Formula: C10H15ClN2O2S MolecularWeight: 262.7563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)CSC#N)NC(=O)CCCCl

Isomeric SMILES

CC(C)(C(=O)CSC#N)NC(=O)CCCCl

InChI

InChI=1S/C10H15ClN2O2S/c1-10(2,8(14)6-16-7-12)13-9(15)4-3-5-11/h3-6H2,1-2H3,(H,13,15)