(E)-18-[5-(2,3-dihydro-1H-inden-1-ylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide

Systemtic Name: (E)-18-[5-(2,3-dihydro-1H-inden-1-ylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide Openeye Name: (E)-18-[5-(indan-1-ylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide CAS Name: (E)-18-[5-(2,3-dihydro-1H-inden-1-ylamino)-1,3,4-thiadiazol-2-yl]-9-octadecenamide IUPAC Name: (E)-18-[5-(2,3-dihydro-1H-inden-1-ylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide Traditional Name: (E)-18-[5-(indan-1-ylamino)-1,3,4-thiadiazol-2-yl]octadec-9-enamide Formula: C29H44N4OS MolecularWeight: 496.75086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C1NC3=NN=C(S3)CCCCCCCCC=CCCCCCCCC(=O)N

Isomeric SMILES

C1CC2=CC=CC=C2C1NC3=NN=C(S3)CCCCCCCC/C=C/CCCCCCCC(=O)N

InChI

InChI=1S/C29H44N4OS/c30-27(34)20-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-21-28-32-33-29(35-28)31-26-23-22-24-18-16-17-19-25(24)26/h1-2,16-19,26H,3-15,20-23H2,(H2,30,34)(H,31,33)/b2-1+