3-azanyl-1-(furan-2-ylmethylsulfanyl)-4-methyl-pentan-2-one

Systemtic Name: 3-azanyl-1-(furan-2-ylmethylsulfanyl)-4-methyl-pentan-2-one Openeye Name: 3-amino-1-(2-furylmethylsulfanyl)-4-methyl-pentan-2-one CAS Name: 3-amino-1-(2-furanylmethylthio)-4-methyl-2-pentanone IUPAC Name: 3-amino-1-(furan-2-ylmethylsulfanyl)-4-methylpentan-2-one Traditional Name: 3-amino-1-(2-furfurylthio)-4-methyl-pentan-2-one Formula: C11H17NO2S MolecularWeight: 227.32318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)CSCC1=CC=CO1)N

Isomeric SMILES

CC(C)C(C(=O)CSCC1=CC=CO1)N

InChI

InChI=1S/C11H17NO2S/c1-8(2)11(12)10(13)7-15-6-9-4-3-5-14-9/h3-5,8,11H,6-7,12H2,1-2H3