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

Systemtic Name: 5-[1-[4-[(5-butyl-3-propan-2-yl-1,2,4-triazol-1-yl)methyl]phenyl]pyrrol-2-yl]-2H-1,2,3,4-tetrazole Openeye Name: 5-[1-[4-[(5-butyl-3-isopropyl-1,2,4-triazol-1-yl)methyl]phenyl]pyrrol-2-yl]-2H-tetrazole CAS Name: 5-[1-[4-[(5-butyl-3-propan-2-yl-1,2,4-triazol-1-yl)methyl]phenyl]-2-pyrrolyl]-2H-tetrazole IUPAC Name: 5-[1-[4-[(5-butyl-3-propan-2-yl-1,2,4-triazol-1-yl)methyl]phenyl]pyrrol-2-yl]-2H-tetrazole Traditional Name: 5-[1-[4-[(5-butyl-3-isopropyl-1,2,4-triazol-1-yl)methyl]phenyl]pyrrol-2-yl]-2H-tetrazole Formula: C21H26N8 MolecularWeight: 390.48474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NN1CC2=CC=C(C=C2)N3C=CC=C3C4=NNN=N4)C(C)C

Isomeric SMILES

CCCCC1=NC(=NN1CC2=CC=C(C=C2)N3C=CC=C3C4=NNN=N4)C(C)C

InChI

InChI=1S/C21H26N8/c1-4-5-8-19-22-20(15(2)3)25-29(19)14-16-9-11-17(12-10-16)28-13-6-7-18(28)21-23-26-27-24-21/h6-7,9-13,15H,4-5,8,14H2,1-3H3,(H,23,24,26,27)