2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methyl-3-phenyl-1H-1,5-benzodiazepin-4-yl)ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methyl-3-phenyl-1H-1,5-benzodiazepin-4-yl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methyl-3-phenyl-1H-1,5-benzodiazepin-4-yl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-methyl-3-phenyl-1H-1,5-benzodiazepin-4-yl)acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methyl-3-phenyl-1H-1,5-benzodiazepin-4-yl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-methyl-3-phenyl-1H-1,5-benzodiazepin-4-yl)acetamide Formula: C25H20N4OS2 MolecularWeight: 456.5825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C2N1)NC(=O)CSC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C2N1)NC(=O)CSC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C25H20N4OS2/c1-16-23(17-9-3-2-4-10-17)24(27-19-12-6-5-11-18(19)26-16)29-22(30)15-31-25-28-20-13-7-8-14-21(20)32-25/h2-14,26H,15H2,1H3,(H,27,29,30)