N-(2-azanyl-5-propylsulfanyl-phenyl)-2-methyl-propanamide

Systemtic Name: N-(2-azanyl-5-propylsulfanyl-phenyl)-2-methyl-propanamide Openeye Name: N-(2-amino-5-propylsulfanyl-phenyl)-2-methyl-propanamide CAS Name: N-[2-amino-5-(propylthio)phenyl]-2-methylpropanamide IUPAC Name: N-(2-amino-5-propylsulfanylphenyl)-2-methylpropanamide Traditional Name: N-[2-amino-5-(propylthio)phenyl]-2-methyl-propionamide Formula: C13H20N2OS MolecularWeight: 252.3757

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC(=C(C=C1)N)NC(=O)C(C)C

Isomeric SMILES

CCCSC1=CC(=C(C=C1)N)NC(=O)C(C)C

InChI

InChI=1S/C13H20N2OS/c1-4-7-17-10-5-6-11(14)12(8-10)15-13(16)9(2)3/h5-6,8-9H,4,7,14H2,1-3H3,(H,15,16)