4-[[5-(2-phenylazanylethylamino)-1,3,4-thiadiazol-2-yl]carbamoyl]benzenesulfonyl fluoride

Systemtic Name: 4-[[5-(2-phenylazanylethylamino)-1,3,4-thiadiazol-2-yl]carbamoyl]benzenesulfonyl fluoride Openeye Name: 4-[[5-(2-anilinoethylamino)-1,3,4-thiadiazol-2-yl]carbamoyl]benzenesulfonyl fluoride CAS Name: 4-[[[5-(2-anilinoethylamino)-1,3,4-thiadiazol-2-yl]amino]-oxomethyl]benzenesulfonyl fluoride IUPAC Name: 4-[[5-(2-anilinoethylamino)-1,3,4-thiadiazol-2-yl]carbamoyl]benzenesulfonyl fluoride Traditional Name: 4-[[5-(2-anilinoethylamino)-1,3,4-thiadiazol-2-yl]carbamoyl]benzenesulfonyl fluoride Formula: C17H16FN5O3S2 MolecularWeight: 421.469043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NCCNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)F

Isomeric SMILES

C1=CC=C(C=C1)NCCNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)F

InChI

InChI=1S/C17H16FN5O3S2/c18-28(25,26)14-8-6-12(7-9-14)15(24)21-17-23-22-16(27-17)20-11-10-19-13-4-2-1-3-5-13/h1-9,19H,10-11H2,(H,20,22)(H,21,23,24)