1-methyl-3-[[methyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-2-sulfanylidene-benzimidazole-5-sulfonamide

Systemtic Name: 1-methyl-3-[[methyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-2-sulfanylidene-benzimidazole-5-sulfonamide Openeye Name: 3-[[(4-isopropylphenyl)methyl-methyl-amino]methyl]-1-methyl-2-thioxo-benzimidazole-5-sulfonamide CAS Name: 1-methyl-3-[[methyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-2-sulfanylidene-5-benzimidazolesulfonamide IUPAC Name: 1-methyl-3-[[methyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-2-sulfanylidenebenzimidazole-5-sulfonamide Traditional Name: 3-[[(4-isopropylbenzyl)-methyl-amino]methyl]-1-methyl-2-thioxo-benzimidazole-5-sulfonamide Formula: C20H26N4O2S2 MolecularWeight: 418.57604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN(C)CN2C3=C(C=CC(=C3)S(=O)(=O)N)N(C2=S)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN(C)CN2C3=C(C=CC(=C3)S(=O)(=O)N)N(C2=S)C

InChI

InChI=1S/C20H26N4O2S2/c1-14(2)16-7-5-15(6-8-16)12-22(3)13-24-19-11-17(28(21,25)26)9-10-18(19)23(4)20(24)27/h5-11,14H,12-13H2,1-4H3,(H2,21,25,26)