tert-butyl N-[4-(5-cyanopyridin-2-yl)sulfanylcyclohexyl]carbamate

Systemtic Name: tert-butyl N-[4-(5-cyanopyridin-2-yl)sulfanylcyclohexyl]carbamate Openeye Name: tert-butyl N-[4-[(5-cyano-2-pyridyl)sulfanyl]cyclohexyl]carbamate CAS Name: N-[4-[(5-cyano-2-pyridinyl)thio]cyclohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(5-cyanopyridin-2-yl)sulfanylcyclohexyl]carbamate Traditional Name: N-[4-[(5-cyano-2-pyridyl)thio]cyclohexyl]carbamic acid tert-butyl ester Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(CC1)SC2=NC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCC(CC1)SC2=NC=C(C=C2)C#N

InChI

InChI=1S/C17H23N3O2S/c1-17(2,3)22-16(21)20-13-5-7-14(8-6-13)23-15-9-4-12(10-18)11-19-15/h4,9,11,13-14H,5-8H2,1-3H3,(H,20,21)