N-(3-bromophenyl)-5-[(5-nitrothiophen-3-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(3-bromophenyl)-5-[(5-nitrothiophen-3-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-(3-bromophenyl)-5-[(5-nitro-3-thienyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(3-bromophenyl)-5-[(5-nitro-3-thiophenyl)methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-bromophenyl)-5-[(5-nitrothiophen-3-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: (3-bromophenyl)-[5-[(5-nitro-3-thienyl)methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C13H9BrN4O2S3 MolecularWeight: 429.33516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=NN=C(S2)SCC3=CSC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=NN=C(S2)SCC3=CSC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H9BrN4O2S3/c14-9-2-1-3-10(5-9)15-12-16-17-13(23-12)22-7-8-4-11(18(19)20)21-6-8/h1-6H,7H2,(H,15,16)