N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2H-benzotriazole-5-carboxamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2H-benzotriazole-5-carboxamide CAS Name: N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2H-benzotriazole-5-carboxamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-2H-benzotriazole-5-carboxamide Formula: C16H12N6OS2 MolecularWeight: 368.43608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC4=NNN=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC4=NNN=C4C=C3

InChI

InChI=1S/C16H12N6OS2/c23-14(11-6-7-12-13(8-11)19-22-18-12)17-15-20-21-16(25-15)24-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,17,20,23)(H,18,19,22)