1-ethyl-N,N-dimethyl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-N,N-dimethyl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzimidazole-5-sulfonamide Openeye Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide CAS Name: 1-ethyl-N,N-dimethyl-2-[[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]thio]methyl]-5-benzimidazolesulfonamide IUPAC Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1-ethyl-N,N-dimethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Formula: C21H24N6O2S3 MolecularWeight: 488.64926

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NN=C(S3)NCC4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NN=C(S3)NCC4=CC=CC=C4

InChI

InChI=1S/C21H24N6O2S3/c1-4-27-18-11-10-16(32(28,29)26(2)3)12-17(18)23-19(27)14-30-21-25-24-20(31-21)22-13-15-8-6-5-7-9-15/h5-12H,4,13-14H2,1-3H3,(H,22,24)