5-[(1-methylbenzimidazol-2-yl)methyl]-N-(4-morpholin-4-ylsulfonylphenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(1-methylbenzimidazol-2-yl)methyl]-N-(4-morpholin-4-ylsulfonylphenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(1-methylbenzimidazol-2-yl)methyl]-N-(4-morpholinosulfonylphenyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(1-methyl-2-benzimidazolyl)methyl]-N-[4-(4-morpholinylsulfonyl)phenyl]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(1-methylbenzimidazol-2-yl)methyl]-N-(4-morpholin-4-ylsulfonylphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(1-methylbenzimidazol-2-yl)methyl]-1,3,4-thiadiazol-2-yl]-(4-morpholinosulfonylphenyl)amine Formula: C21H22N6O3S2 MolecularWeight: 470.56778

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1CC3=NN=C(S3)NC4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CN1C2=CC=CC=C2N=C1CC3=NN=C(S3)NC4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C21H22N6O3S2/c1-26-18-5-3-2-4-17(18)23-19(26)14-20-24-25-21(31-20)22-15-6-8-16(9-7-15)32(28,29)27-10-12-30-13-11-27/h2-9H,10-14H2,1H3,(H,22,25)