N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-[4-(phenylcarbamoylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-[4-(phenylcarbamoylamino)phenyl]sulfanyl-propanamide Openeye Name: N-[4-(4-bromophenyl)thiazol-2-yl]-2-[4-(phenylcarbamoylamino)phenyl]sulfanyl-propanamide CAS Name: 2-[[4-[[anilino(oxo)methyl]amino]phenyl]thio]-N-[4-(4-bromophenyl)-2-thiazolyl]propanamide IUPAC Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-[4-(phenylcarbamoylamino)phenyl]sulfanylpropanamide Traditional Name: N-[4-(4-bromophenyl)thiazol-2-yl]-2-[[4-(phenylcarbamoylamino)phenyl]thio]propionamide Formula: C25H21BrN4O2S2 MolecularWeight: 553.49384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)Br)SC3=CC=C(C=C3)NC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)Br)SC3=CC=C(C=C3)NC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H21BrN4O2S2/c1-16(23(31)30-25-29-22(15-33-25)17-7-9-18(26)10-8-17)34-21-13-11-20(12-14-21)28-24(32)27-19-5-3-2-4-6-19/h2-16H,1H3,(H2,27,28,32)(H,29,30,31)