2-chloranyl-N-[5-(phenylcarbamothioylamino)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[5-(phenylcarbamothioylamino)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 2-chloro-N-[5-(phenylcarbamothioylamino)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-[5-[[anilino(sulfanylidene)methyl]amino]-1,3,4-thiadiazol-2-yl]-2-chlorobenzamide IUPAC Name: 2-chloro-N-[5-(phenylcarbamothioylamino)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 2-chloro-N-[5-(phenylthiocarbamoylamino)-1,3,4-thiadiazol-2-yl]benzamide Formula: C16H12ClN5OS2 MolecularWeight: 389.88238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=NN=C(S2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=NN=C(S2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C16H12ClN5OS2/c17-12-9-5-4-8-11(12)13(23)19-15-21-22-16(25-15)20-14(24)18-10-6-2-1-3-7-10/h1-9H,(H,19,21,23)(H2,18,20,22,24)