3-[2-[[1-methyl-2-(4-methylphenyl)indol-3-yl]diazenyl]-2H-1,3-benzothiazol-3-yl]propanamide

Systemtic Name: 3-[2-[[1-methyl-2-(4-methylphenyl)indol-3-yl]diazenyl]-2H-1,3-benzothiazol-3-yl]propanamide Openeye Name: 3-[2-[1-methyl-2-(p-tolyl)indol-3-yl]azo-2H-1,3-benzothiazol-3-yl]propanamide CAS Name: 3-[2-[[1-methyl-2-(4-methylphenyl)-3-indolyl]azo]-2H-1,3-benzothiazol-3-yl]propanamide IUPAC Name: 3-[2-[[1-methyl-2-(4-methylphenyl)indol-3-yl]diazenyl]-2H-1,3-benzothiazol-3-yl]propanamide Traditional Name: 3-[2-[1-methyl-2-(p-tolyl)indol-3-yl]azo-2H-1,3-benzothiazol-3-yl]propionamide Formula: C26H25N5OS MolecularWeight: 455.5746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2C)N=NC4N(C5=CC=CC=C5S4)CCC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2C)N=NC4N(C5=CC=CC=C5S4)CCC(=O)N

InChI

InChI=1S/C26H25N5OS/c1-17-11-13-18(14-12-17)25-24(19-7-3-4-8-20(19)30(25)2)28-29-26-31(16-15-23(27)32)21-9-5-6-10-22(21)33-26/h3-14,26H,15-16H2,1-2H3,(H2,27,32)