5-(4-bromophenyl)sulfonyl-N-[5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-thiadiazol-2-yl]furan-2-carboxamide

Systemtic Name: 5-(4-bromophenyl)sulfonyl-N-[5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-thiadiazol-2-yl]furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)sulfonyl-N-[5-[(E)-cinnamyl]sulfanyl-1,3,4-thiadiazol-2-yl]furan-2-carboxamide CAS Name: 5-(4-bromophenyl)sulfonyl-N-[5-[[(E)-3-phenylprop-2-enyl]thio]-1,3,4-thiadiazol-2-yl]-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)sulfonyl-N-[5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-thiadiazol-2-yl]furan-2-carboxamide Traditional Name: 5-brosyl-N-[5-[[(E)-cinnamyl]thio]-1,3,4-thiadiazol-2-yl]-2-furamide Formula: C22H16BrN3O4S3 MolecularWeight: 562.47914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCSC2=NN=C(S2)NC(=O)C3=CC=C(O3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)/C=C/CSC2=NN=C(S2)NC(=O)C3=CC=C(O3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H16BrN3O4S3/c23-16-8-10-17(11-9-16)33(28,29)19-13-12-18(30-19)20(27)24-21-25-26-22(32-21)31-14-4-7-15-5-2-1-3-6-15/h1-13H,14H2,(H,24,25,27)/b7-4+