(4S,5R)-2-methyl-4-(phenylmethylsulfanyl)nonan-5-amine

Systemtic Name: (4S,5R)-2-methyl-4-(phenylmethylsulfanyl)nonan-5-amine Openeye Name: (4S,5R)-4-benzylsulfanyl-2-methyl-nonan-5-amine CAS Name: (4S,5R)-2-methyl-4-(phenylmethylthio)-5-nonanamine IUPAC Name: (4S,5R)-4-benzylsulfanyl-2-methylnonan-5-amine Traditional Name: [(1R,2S)-2-(benzylthio)-1-butyl-4-methyl-pentyl]amine Formula: C17H29NS MolecularWeight: 279.48386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CC(C)C)SCC1=CC=CC=C1)N

Isomeric SMILES

CCCC[C@H]([C@H](CC(C)C)SCC1=CC=CC=C1)N

InChI

InChI=1S/C17H29NS/c1-4-5-11-16(18)17(12-14(2)3)19-13-15-9-7-6-8-10-15/h6-10,14,16-17H,4-5,11-13,18H2,1-3H3/t16-,17+/m1/s1