2-[2-[1-(4-bromophenyl)imidazol-2-yl]sulfanylethanoyl-ethyl-amino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-[1-(4-bromophenyl)imidazol-2-yl]sulfanylethanoyl-ethyl-amino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[2-[1-(4-bromophenyl)imidazol-2-yl]sulfanylacetyl]-ethyl-amino]-N-isopropyl-acetamide CAS Name: 2-[[2-[[1-(4-bromophenyl)-2-imidazolyl]thio]-1-oxoethyl]-ethylamino]-N-propan-2-ylacetamide IUPAC Name: 2-[[2-[1-(4-bromophenyl)imidazol-2-yl]sulfanylacetyl]-ethylamino]-N-propan-2-ylacetamide Traditional Name: 2-[[2-[[1-(4-bromophenyl)imidazol-2-yl]thio]acetyl]-ethyl-amino]-N-isopropyl-acetamide Formula: C18H23BrN4O2S MolecularWeight: 439.36982

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC(C)C)C(=O)CSC1=NC=CN1C2=CC=C(C=C2)Br

Isomeric SMILES

CCN(CC(=O)NC(C)C)C(=O)CSC1=NC=CN1C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H23BrN4O2S/c1-4-22(11-16(24)21-13(2)3)17(25)12-26-18-20-9-10-23(18)15-7-5-14(19)6-8-15/h5-10,13H,4,11-12H2,1-3H3,(H,21,24)