N-[3-methyl-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[3-methyl-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-methyl-1-[3-methyl-4-(m-tolyl)piperazine-1-carbonyl]propyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[3-methyl-1-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-1-oxobutan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[3-methyl-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-1-oxobutan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[2-methyl-1-[3-methyl-4-(m-tolyl)piperazine-1-carbonyl]propyl]piazthiole-4-sulfonamide Formula: C23H29N5O3S2 MolecularWeight: 487.63806

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C(C(C)C)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C(C(C)C)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C23H29N5O3S2/c1-15(2)21(26-33(30,31)20-10-6-9-19-22(20)25-32-24-19)23(29)27-11-12-28(17(4)14-27)18-8-5-7-16(3)13-18/h5-10,13,15,17,21,26H,11-12,14H2,1-4H3