N-[5-(1H-benzimidazol-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-propan-2-yl-benzamide

Systemtic Name: N-[5-(1H-benzimidazol-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-propan-2-yl-benzamide Openeye Name: N-[5-(1H-benzimidazol-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-isopropyl-benzamide CAS Name: N-[5-(1H-benzimidazol-2-ylmethylthio)-1,3,4-thiadiazol-2-yl]-4-propan-2-ylbenzamide IUPAC Name: N-[5-(1H-benzimidazol-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-propan-2-ylbenzamide Traditional Name: N-[5-(1H-benzimidazol-2-ylmethylthio)-1,3,4-thiadiazol-2-yl]-4-isopropyl-benzamide Formula: C20H19N5OS2 MolecularWeight: 409.52776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H19N5OS2/c1-12(2)13-7-9-14(10-8-13)18(26)23-19-24-25-20(28-19)27-11-17-21-15-5-3-4-6-16(15)22-17/h3-10,12H,11H2,1-2H3,(H,21,22)(H,23,24,26)