4-bromanyl-N-[2-[2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl]sulfanyl-4,5,6,7-tetrahydrobenzimidazol-1-yl]benzamide

Systemtic Name: 4-bromanyl-N-[2-[2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl]sulfanyl-4,5,6,7-tetrahydrobenzimidazol-1-yl]benzamide Openeye Name: 4-bromo-N-[2-[2-(N-isopropylanilino)-2-oxo-ethyl]sulfanyl-4,5,6,7-tetrahydrobenzimidazol-1-yl]benzamide CAS Name: 4-bromo-N-[2-[[2-oxo-2-(N-propan-2-ylanilino)ethyl]thio]-4,5,6,7-tetrahydrobenzimidazol-1-yl]benzamide IUPAC Name: 4-bromo-N-[2-[2-oxo-2-(N-propan-2-ylanilino)ethyl]sulfanyl-4,5,6,7-tetrahydrobenzimidazol-1-yl]benzamide Traditional Name: 4-bromo-N-[2-[[2-(N-isopropylanilino)-2-keto-ethyl]thio]-4,5,6,7-tetrahydrobenzimidazol-1-yl]benzamide Formula: C25H27BrN4O2S MolecularWeight: 527.47648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)CSC2=NC3=C(N2NC(=O)C4=CC=C(C=C4)Br)CCCC3

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)CSC2=NC3=C(N2NC(=O)C4=CC=C(C=C4)Br)CCCC3

InChI

InChI=1S/C25H27BrN4O2S/c1-17(2)29(20-8-4-3-5-9-20)23(31)16-33-25-27-21-10-6-7-11-22(21)30(25)28-24(32)18-12-14-19(26)15-13-18/h3-5,8-9,12-15,17H,6-7,10-11,16H2,1-2H3,(H,28,32)