2-azanyl-4-methyl-1-(phenylmethylsulfanyl)pentan-3-one

Systemtic Name: 2-azanyl-4-methyl-1-(phenylmethylsulfanyl)pentan-3-one Openeye Name: 2-amino-1-benzylsulfanyl-4-methyl-pentan-3-one CAS Name: 2-amino-4-methyl-1-(phenylmethylthio)-3-pentanone IUPAC Name: 2-amino-1-benzylsulfanyl-4-methylpentan-3-one Traditional Name: 2-amino-1-(benzylthio)-4-methyl-pentan-3-one Formula: C13H19NOS MolecularWeight: 237.36106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(CSCC1=CC=CC=C1)N

Isomeric SMILES

CC(C)C(=O)C(CSCC1=CC=CC=C1)N

InChI

InChI=1S/C13H19NOS/c1-10(2)13(15)12(14)9-16-8-11-6-4-3-5-7-11/h3-7,10,12H,8-9,14H2,1-2H3