3-(2-bromanyl-4-methyl-phenoxy)pentanethioamide

Systemtic Name: 3-(2-bromanyl-4-methyl-phenoxy)pentanethioamide Openeye Name: 3-(2-bromo-4-methyl-phenoxy)pentanethioamide CAS Name: 3-(2-bromo-4-methylphenoxy)pentanethioamide IUPAC Name: 3-(2-bromo-4-methylphenoxy)pentanethioamide Traditional Name: 3-(2-bromo-4-methyl-phenoxy)thiovaleramide Formula: C12H16BrNOS MolecularWeight: 302.23054

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=S)N)OC1=C(C=C(C=C1)C)Br

Isomeric SMILES

CCC(CC(=S)N)OC1=C(C=C(C=C1)C)Br

InChI

InChI=1S/C12H16BrNOS/c1-3-9(7-12(14)16)15-11-5-4-8(2)6-10(11)13/h4-6,9H,3,7H2,1-2H3,(H2,14,16)