5-(2-chloranyl-4-nitro-phenyl)sulfanyl-N-(phenylmethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(2-chloranyl-4-nitro-phenyl)sulfanyl-N-(phenylmethyl)-1,3,4-thiadiazol-2-amine Openeye Name: N-benzyl-5-(2-chloro-4-nitro-phenyl)sulfanyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(2-chloro-4-nitrophenyl)thio]-N-(phenylmethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: N-benzyl-5-(2-chloro-4-nitrophenyl)sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: benzyl-[5-[(2-chloro-4-nitro-phenyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C15H11ClN4O2S2 MolecularWeight: 378.85644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NN=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NN=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H11ClN4O2S2/c16-12-8-11(20(21)22)6-7-13(12)23-15-19-18-14(24-15)17-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,17,18)