4-(1,3-benzothiazol-2-yl)-N-[[3-[(4-methylsulfonylphenyl)methyl]imidazol-4-yl]methyl]-3-phenyl-aniline

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[[3-[(4-methylsulfonylphenyl)methyl]imidazol-4-yl]methyl]-3-phenyl-aniline Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[[3-[(4-methylsulfonylphenyl)methyl]imidazol-4-yl]methyl]-3-phenyl-aniline CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[[3-[(4-methylsulfonylphenyl)methyl]-4-imidazolyl]methyl]-3-phenylaniline IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[[3-[(4-methylsulfonylphenyl)methyl]imidazol-4-yl]methyl]-3-phenylaniline Traditional Name: [4-(1,3-benzothiazol-2-yl)-3-phenyl-phenyl]-[[3-(4-mesylbenzyl)imidazol-4-yl]methyl]amine Formula: C31H26N4O2S2 MolecularWeight: 550.69374

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CN2C=NC=C2CNC3=CC(=C(C=C3)C4=NC5=CC=CC=C5S4)C6=CC=CC=C6

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CN2C=NC=C2CNC3=CC(=C(C=C3)C4=NC5=CC=CC=C5S4)C6=CC=CC=C6

InChI

InChI=1S/C31H26N4O2S2/c1-39(36,37)26-14-11-22(12-15-26)20-35-21-32-18-25(35)19-33-24-13-16-27(28(17-24)23-7-3-2-4-8-23)31-34-29-9-5-6-10-30(29)38-31/h2-18,21,33H,19-20H2,1H3