5-[1-[4-[(5-butyl-3-chloranyl-1,2,4-triazol-1-yl)methyl]phenyl]-5-chloranyl-pyrrol-2-yl]-2H-1,2,3,4-tetrazole

Systemtic Name: 5-[1-[4-[(5-butyl-3-chloranyl-1,2,4-triazol-1-yl)methyl]phenyl]-5-chloranyl-pyrrol-2-yl]-2H-1,2,3,4-tetrazole Openeye Name: 5-[1-[4-[(5-butyl-3-chloro-1,2,4-triazol-1-yl)methyl]phenyl]-5-chloro-pyrrol-2-yl]-2H-tetrazole CAS Name: 5-[1-[4-[(5-butyl-3-chloro-1,2,4-triazol-1-yl)methyl]phenyl]-5-chloro-2-pyrrolyl]-2H-tetrazole IUPAC Name: 5-[1-[4-[(5-butyl-3-chloro-1,2,4-triazol-1-yl)methyl]phenyl]-5-chloropyrrol-2-yl]-2H-tetrazole Traditional Name: 5-[1-[4-[(5-butyl-3-chloro-1,2,4-triazol-1-yl)methyl]phenyl]-5-chloro-pyrrol-2-yl]-2H-tetrazole Formula: C18H18Cl2N8 MolecularWeight: 417.29512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NN1CC2=CC=C(C=C2)N3C(=CC=C3Cl)C4=NNN=N4)Cl

Isomeric SMILES

CCCCC1=NC(=NN1CC2=CC=C(C=C2)N3C(=CC=C3Cl)C4=NNN=N4)Cl

InChI

InChI=1S/C18H18Cl2N8/c1-2-3-4-16-21-18(20)24-27(16)11-12-5-7-13(8-6-12)28-14(9-10-15(28)19)17-22-25-26-23-17/h5-10H,2-4,11H2,1H3,(H,22,23,25,26)