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

Systemtic Name: 4-bromanyl-N-[5-(2-phenylazanylethylamino)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-[5-(2-anilinoethylamino)-1,3,4-thiadiazol-2-yl]-4-bromo-benzamide CAS Name: N-[5-(2-anilinoethylamino)-1,3,4-thiadiazol-2-yl]-4-bromobenzamide IUPAC Name: N-[5-(2-anilinoethylamino)-1,3,4-thiadiazol-2-yl]-4-bromobenzamide Traditional Name: N-[5-(2-anilinoethylamino)-1,3,4-thiadiazol-2-yl]-4-bromo-benzamide Formula: C17H16BrN5OS MolecularWeight: 418.31084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN5OS/c18-13-8-6-12(7-9-13)15(24)21-17-23-22-16(25-17)20-11-10-19-14-4-2-1-3-5-14/h1-9,19H,10-11H2,(H,20,22)(H,21,23,24)