(E)-N-[5-[(4-sulfamoylphenyl)methylamino]-1,3,4-thiadiazol-2-yl]octadec-9-enamide

Systemtic Name: (E)-N-[5-[(4-sulfamoylphenyl)methylamino]-1,3,4-thiadiazol-2-yl]octadec-9-enamide Openeye Name: (E)-N-[5-[(4-sulfamoylphenyl)methylamino]-1,3,4-thiadiazol-2-yl]octadec-9-enamide CAS Name: (E)-N-[5-[(4-sulfamoylphenyl)methylamino]-1,3,4-thiadiazol-2-yl]-9-octadecenamide IUPAC Name: (E)-N-[5-[(4-sulfamoylphenyl)methylamino]-1,3,4-thiadiazol-2-yl]octadec-9-enamide Traditional Name: (E)-N-[5-[(4-sulfamoylbenzyl)amino]-1,3,4-thiadiazol-2-yl]octadec-9-enamide Formula: C27H43N5O3S2 MolecularWeight: 549.79202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC1=NN=C(S1)NCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NC1=NN=C(S1)NCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C27H43N5O3S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(33)30-27-32-31-26(36-27)29-22-23-18-20-24(21-19-23)37(28,34)35/h9-10,18-21H,2-8,11-17,22H2,1H3,(H,29,31)(H2,28,34,35)(H,30,32,33)/b10-9+