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

Systemtic Name: 4-bromanyl-N-[[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]carbamothioyl]benzamide Openeye Name: N-[(5-benzyl-1,3,4-thiadiazol-2-yl)carbamothioyl]-4-bromo-benzamide CAS Name: 4-bromo-N-[[[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(5-benzyl-1,3,4-thiadiazol-2-yl)carbamothioyl]-4-bromobenzamide Traditional Name: N-[(5-benzyl-1,3,4-thiadiazol-2-yl)thiocarbamoyl]-4-bromo-benzamide Formula: C17H13BrN4OS2 MolecularWeight: 433.34532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(S2)NC(=S)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(S2)NC(=S)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H13BrN4OS2/c18-13-8-6-12(7-9-13)15(23)19-16(24)20-17-22-21-14(25-17)10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,19,20,22,23,24)