2-[[5-(4-methylhexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(2-methyl-1H-indol-3-yl)ethanone

Systemtic Name: 2-[[5-(4-methylhexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(2-methyl-1H-indol-3-yl)ethanone Openeye Name: 2-[[5-(4-methylhexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(2-methyl-1H-indol-3-yl)ethanone CAS Name: 2-[[5-(4-methylhexylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(2-methyl-1H-indol-3-yl)ethanone IUPAC Name: 2-[[5-(4-methylhexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(2-methyl-1H-indol-3-yl)ethanone Traditional Name: 2-[[5-(4-methylhexylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(2-methyl-1H-indol-3-yl)ethanone Formula: C20H26N4OS2 MolecularWeight: 402.57664

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCNC1=NN=C(S1)SCC(=O)C2=C(NC3=CC=CC=C32)C

Isomeric SMILES

CCC(C)CCCNC1=NN=C(S1)SCC(=O)C2=C(NC3=CC=CC=C32)C

InChI

InChI=1S/C20H26N4OS2/c1-4-13(2)8-7-11-21-19-23-24-20(27-19)26-12-17(25)18-14(3)22-16-10-6-5-9-15(16)18/h5-6,9-10,13,22H,4,7-8,11-12H2,1-3H3,(H,21,23)