3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-sulfanylidene-1H-benzo[g]quinazolin-4-one

Systemtic Name: 3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-sulfanylidene-1H-benzo[g]quinazolin-4-one Openeye Name: 3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-thioxo-1H-benzo[g]quinazolin-4-one CAS Name: 3-[3-(4-methyl-1-piperazine-1,4-diiumyl)propyl]-2-sulfanylidene-1H-benzo[g]quinazolin-4-one IUPAC Name: 3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-sulfanylidene-1H-benzo[g]quinazolin-4-one Traditional Name: 3-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-thioxo-1H-benzo[g]quinazolin-4-one Formula: C20H26N4OS+2 MolecularWeight: 370.51164

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCN2C(=O)C3=CC4=CC=CC=C4C=C3NC2=S

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCN2C(=O)C3=CC4=CC=CC=C4C=C3NC2=S

InChI

InChI=1S/C20H24N4OS/c1-22-9-11-23(12-10-22)7-4-8-24-19(25)17-13-15-5-2-3-6-16(15)14-18(17)21-20(24)26/h2-3,5-6,13-14H,4,7-12H2,1H3,(H,21,26)/p+2