2-[2-(2-azanyl-4-bromanyl-phenyl)sulfanylethanoyl-methyl-amino]-N-propyl-ethanamide

Systemtic Name: 2-[2-(2-azanyl-4-bromanyl-phenyl)sulfanylethanoyl-methyl-amino]-N-propyl-ethanamide Openeye Name: 2-[[2-(2-amino-4-bromo-phenyl)sulfanylacetyl]-methyl-amino]-N-propyl-acetamide CAS Name: 2-[[2-[(2-amino-4-bromophenyl)thio]-1-oxoethyl]-methylamino]-N-propylacetamide IUPAC Name: 2-[[2-(2-amino-4-bromophenyl)sulfanylacetyl]-methylamino]-N-propylacetamide Traditional Name: 2-[[2-[(2-amino-4-bromo-phenyl)thio]acetyl]-methyl-amino]-N-propyl-acetamide Formula: C14H20BrN3O2S MolecularWeight: 374.2965

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)C(=O)CSC1=C(C=C(C=C1)Br)N

Isomeric SMILES

CCCNC(=O)CN(C)C(=O)CSC1=C(C=C(C=C1)Br)N

InChI

InChI=1S/C14H20BrN3O2S/c1-3-6-17-13(19)8-18(2)14(20)9-21-12-5-4-10(15)7-11(12)16/h4-5,7H,3,6,8-9,16H2,1-2H3,(H,17,19)