2-(2-chloranyl-4-nitro-phenyl)sulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine

Systemtic Name: 2-(2-chloranyl-4-nitro-phenyl)sulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine Openeye Name: 2-(2-chloro-4-nitro-phenyl)sulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine CAS Name: 2-[(2-chloro-4-nitrophenyl)thio]-[1,2,4]triazolo[1,5-a]pyrimidine IUPAC Name: 2-(2-chloro-4-nitrophenyl)sulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine Traditional Name: 2-[(2-chloro-4-nitro-phenyl)thio]-[1,2,4]triazolo[1,5-a]pyrimidine Formula: C11H6ClN5O2S MolecularWeight: 307.71564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN2C(=NC(=N2)SC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N=C1

Isomeric SMILES

C1=CN2C(=NC(=N2)SC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N=C1

InChI

InChI=1S/C11H6ClN5O2S/c12-8-6-7(17(18)19)2-3-9(8)20-11-14-10-13-4-1-5-16(10)15-11/h1-6H