3-[3-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[3-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]thio]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]thio]propyl]-1H-benzimidazol-2-one Formula: C16H21N5OS2 MolecularWeight: 363.50084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NN=C(S1)SCCCN2C3=CC=CC=C3NC2=O

Isomeric SMILES

CC(C)CNC1=NN=C(S1)SCCCN2C3=CC=CC=C3NC2=O

InChI

InChI=1S/C16H21N5OS2/c1-11(2)10-17-14-19-20-16(24-14)23-9-5-8-21-13-7-4-3-6-12(13)18-15(21)22/h3-4,6-7,11H,5,8-10H2,1-2H3,(H,17,19)(H,18,22)