2-[2-azanyl-5-(phenylmethylsulfanyl)-2H-1,3,4-thiadiazol-3-yl]-1-phenyl-ethanone

Systemtic Name: 2-[2-azanyl-5-(phenylmethylsulfanyl)-2H-1,3,4-thiadiazol-3-yl]-1-phenyl-ethanone Openeye Name: 2-(2-amino-5-benzylsulfanyl-2H-1,3,4-thiadiazol-3-yl)-1-phenyl-ethanone CAS Name: 2-[2-amino-5-(phenylmethylthio)-2H-1,3,4-thiadiazol-3-yl]-1-phenylethanone IUPAC Name: 2-(2-amino-5-benzylsulfanyl-2H-1,3,4-thiadiazol-3-yl)-1-phenylethanone Traditional Name: 2-[2-amino-5-(benzylthio)-2H-1,3,4-thiadiazol-3-yl]-1-phenyl-ethanone Formula: C17H17N3OS2 MolecularWeight: 343.46638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN(C(S2)N)CC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN(C(S2)N)CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3OS2/c18-16-20(11-15(21)14-9-5-2-6-10-14)19-17(23-16)22-12-13-7-3-1-4-8-13/h1-10,16H,11-12,18H2