3-[2-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanyl]ethanoyl-(4-methoxyphenyl)amino]propanamide

Systemtic Name: 3-[2-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanyl]ethanoyl-(4-methoxyphenyl)amino]propanamide Openeye Name: 3-(N-[2-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanyl]acetyl]-4-methoxy-anilino)propanamide CAS Name: 3-(N-[2-[[5-(4-bromophenyl)-1H-imidazol-2-yl]thio]-1-oxoethyl]-4-methoxyanilino)propanamide IUPAC Name: 3-(N-[2-[[5-(4-bromophenyl)-1H-imidazol-2-yl]sulfanyl]acetyl]-4-methoxyanilino)propanamide Traditional Name: 3-(N-[2-[[5-(4-bromophenyl)-1H-imidazol-2-yl]thio]acetyl]-4-methoxy-anilino)propionamide Formula: C21H21BrN4O3S MolecularWeight: 489.38544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CCC(=O)N)C(=O)CSC2=NC=C(N2)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)N(CCC(=O)N)C(=O)CSC2=NC=C(N2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H21BrN4O3S/c1-29-17-8-6-16(7-9-17)26(11-10-19(23)27)20(28)13-30-21-24-12-18(25-21)14-2-4-15(22)5-3-14/h2-9,12H,10-11,13H2,1H3,(H2,23,27)(H,24,25)