propan-2-yl N-[2-(aminomethyl)-1-(3-methylbutanoyl)-2-propyl-6-propylsulfanyl-cyclohexyl]carbamate

Systemtic Name: propan-2-yl N-[2-(aminomethyl)-1-(3-methylbutanoyl)-2-propyl-6-propylsulfanyl-cyclohexyl]carbamate Openeye Name: isopropyl N-[2-(aminomethyl)-1-(3-methylbutanoyl)-2-propyl-6-propylsulfanyl-cyclohexyl]carbamate CAS Name: N-[2-(aminomethyl)-1-(3-methyl-1-oxobutyl)-2-propyl-6-(propylthio)cyclohexyl]carbamic acid propan-2-yl ester IUPAC Name: propan-2-yl N-[2-(aminomethyl)-1-(3-methylbutanoyl)-2-propyl-6-propylsulfanylcyclohexyl]carbamate Traditional Name: N-[2-(aminomethyl)-1-isovaleryl-2-propyl-6-(propylthio)cyclohexyl]carbamic acid isopropyl ester Formula: C22H42N2O3S MolecularWeight: 414.64548

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCC(C1(C(=O)CC(C)C)NC(=O)OC(C)C)SCCC)CN

Isomeric SMILES

CCCC1(CCCC(C1(C(=O)CC(C)C)NC(=O)OC(C)C)SCCC)CN

InChI

InChI=1S/C22H42N2O3S/c1-7-11-21(15-23)12-9-10-19(28-13-8-2)22(21,18(25)14-16(3)4)24-20(26)27-17(5)6/h16-17,19H,7-15,23H2,1-6H3,(H,24,26)