1,1-bis(oxidanylidene)-2-[3-(4-phenylpiperazin-1-yl)propyl]-4H-thieno[2,3-e][1,2,4]thiadiazin-3-one hydrobromide

Systemtic Name: 1,1-bis(oxidanylidene)-2-[3-(4-phenylpiperazin-1-yl)propyl]-4H-thieno[2,3-e][1,2,4]thiadiazin-3-one hydrobromide Openeye Name: 1,1-dioxo-2-[3-(4-phenylpiperazin-1-yl)propyl]-4H-thieno[2,3-e][1,2,4]thiadiazin-3-one hydrobromide CAS Name: 1,1-dioxo-2-[3-(4-phenyl-1-piperazinyl)propyl]-4H-thieno[2,3-e][1,2,4]thiadiazin-3-one hydrobromide IUPAC Name: 1,1-dioxo-2-[3-(4-phenylpiperazin-1-yl)propyl]-4H-thieno[2,3-e][1,2,4]thiadiazin-3-one hydrobromide Traditional Name: 1,1-diketo-2-[3-(4-phenylpiperazino)propyl]-4H-thieno[2,3-e][1,2,4]thiadiazin-3-one hydrobromide Formula: C18H23BrN4O3S2 MolecularWeight: 487.43422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C(=O)NC3=C(S2(=O)=O)C=CS3)C4=CC=CC=C4.Br

Isomeric SMILES

C1CN(CCN1CCCN2C(=O)NC3=C(S2(=O)=O)C=CS3)C4=CC=CC=C4.Br

InChI

InChI=1S/C18H22N4O3S2.BrH/c23-18-19-17-16(7-14-26-17)27(24,25)22(18)9-4-8-20-10-12-21(13-11-20)15-5-2-1-3-6-15;/h1-3,5-7,14H,4,8-13H2,(H,19,23);1H