4-bromanyl-N-[5-(2-phenylsulfanylethylamino)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-bromanyl-N-[5-(2-phenylsulfanylethylamino)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-bromo-N-[5-(2-phenylsulfanylethylamino)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-bromo-N-[5-[2-(phenylthio)ethylamino]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-bromo-N-[5-(2-phenylsulfanylethylamino)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-bromo-N-[5-[2-(phenylthio)ethylamino]-1,3,4-thiadiazol-2-yl]benzamide Formula: C17H15BrN4OS2 MolecularWeight: 435.3612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)SCCNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN4OS2/c18-13-8-6-12(7-9-13)15(23)20-17-22-21-16(25-17)19-10-11-24-14-4-2-1-3-5-14/h1-9H,10-11H2,(H,19,21)(H,20,22,23)