tert-butyl N-(1-cyclohexyl-3-oxidanyl-4-sulfanyl-hept-6-en-2-yl)carbamate

Systemtic Name: tert-butyl N-(1-cyclohexyl-3-oxidanyl-4-sulfanyl-hept-6-en-2-yl)carbamate Openeye Name: tert-butyl N-[1-(cyclohexylmethyl)-2-hydroxy-3-sulfanyl-hex-5-enyl]carbamate CAS Name: N-(1-cyclohexyl-3-hydroxy-4-mercaptohept-6-en-2-yl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(1-cyclohexyl-3-hydroxy-4-sulfanylhept-6-en-2-yl)carbamate Traditional Name: N-[1-(cyclohexylmethyl)-2-hydroxy-3-mercapto-hex-5-enyl]carbamic acid tert-butyl ester Formula: C18H33NO3S MolecularWeight: 343.52452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(C(CC=C)S)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(C(CC=C)S)O

InChI

InChI=1S/C18H33NO3S/c1-5-9-15(23)16(20)14(12-13-10-7-6-8-11-13)19-17(21)22-18(2,3)4/h5,13-16,20,23H,1,6-12H2,2-4H3,(H,19,21)