1-[5-(4-methylpiperazin-1-yl)-4H-thieno[2,3-b][1,4]benzodiazepin-2-yl]ethanone

Systemtic Name: 1-[5-(4-methylpiperazin-1-yl)-4H-thieno[2,3-b][1,4]benzodiazepin-2-yl]ethanone Openeye Name: 1-[5-(4-methylpiperazin-1-yl)-4H-thieno[2,3-b][1,4]benzodiazepin-2-yl]ethanone CAS Name: 1-[5-(4-methyl-1-piperazinyl)-4H-thieno[2,3-b][1,4]benzodiazepin-2-yl]ethanone IUPAC Name: 1-[5-(4-methylpiperazin-1-yl)-4H-thieno[2,3-b][1,4]benzodiazepin-2-yl]ethanone Traditional Name: 1-[5-(4-methylpiperazino)-4H-thieno[2,3-b][1,4]benzodiazepin-2-yl]ethanone Formula: C18H20N4OS MolecularWeight: 340.4426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(S1)N=C3C=CC=CC3=C(N2)N4CCN(CC4)C

Isomeric SMILES

CC(=O)C1=CC2=C(S1)N=C3C=CC=CC3=C(N2)N4CCN(CC4)C

InChI

InChI=1S/C18H20N4OS/c1-12(23)16-11-15-18(24-16)20-14-6-4-3-5-13(14)17(19-15)22-9-7-21(2)8-10-22/h3-6,11,19H,7-10H2,1-2H3