(5E)-2-azanyl-5-[[6-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]methylidene]-1H-imidazol-4-one

Systemtic Name: (5E)-2-azanyl-5-[[6-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]methylidene]-1H-imidazol-4-one Openeye Name: (5E)-2-amino-5-[[6-bromo-1-(p-tolylsulfonyl)indol-3-yl]methylene]-1H-imidazol-4-one CAS Name: (5E)-2-amino-5-[[6-bromo-1-(4-methylphenyl)sulfonyl-3-indolyl]methylidene]-1H-imidazol-4-one IUPAC Name: (5E)-2-amino-5-[[6-bromo-1-(4-methylphenyl)sulfonylindol-3-yl]methylidene]-1H-imidazol-4-one Traditional Name: (5E)-2-amino-5-[(6-bromo-1-tosyl-indol-3-yl)methylene]-2-imidazolin-4-one Formula: C19H15BrN4O3S MolecularWeight: 459.3164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=C(C=C3)Br)C=C4C(=O)N=C(N4)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=C(C=C3)Br)/C=C/4\C(=O)N=C(N4)N

InChI

InChI=1S/C19H15BrN4O3S/c1-11-2-5-14(6-3-11)28(26,27)24-10-12(8-16-18(25)23-19(21)22-16)15-7-4-13(20)9-17(15)24/h2-10H,1H3,(H3,21,22,23,25)/b16-8+