1-methyl-10-[2-(4-methylpiperazin-1-ium-1-yl)ethanoyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one

Systemtic Name: 1-methyl-10-[2-(4-methylpiperazin-1-ium-1-yl)ethanoyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Openeye Name: 1-methyl-10-[2-(4-methylpiperazin-1-ium-1-yl)acetyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one CAS Name: 1-methyl-10-[2-(4-methyl-1-piperazin-1-iumyl)-1-oxoethyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one IUPAC Name: 1-methyl-10-[2-(4-methylpiperazin-1-ium-1-yl)acetyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Traditional Name: 1-methyl-10-[2-(4-methylpiperazin-1-ium-1-yl)acetyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one Formula: C19H23N4O2S+ MolecularWeight: 371.47652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CS1)C(=O)NC3=CC=CC=C3N2C(=O)C[NH+]4CCN(CC4)C

Isomeric SMILES

CC1=C2C(=CS1)C(=O)NC3=CC=CC=C3N2C(=O)C[NH+]4CCN(CC4)C

InChI

InChI=1S/C19H22N4O2S/c1-13-18-14(12-26-13)19(25)20-15-5-3-4-6-16(15)23(18)17(24)11-22-9-7-21(2)8-10-22/h3-6,12H,7-11H2,1-2H3,(H,20,25)/p+1