N-[[4-[2-(1-butyl-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-5-ethyl-1,3,4-thiadiazol-2-amine

Systemtic Name: N-[[4-[2-(1-butyl-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-5-ethyl-1,3,4-thiadiazol-2-amine Openeye Name: N-[[4-[2-(1-butyltetrazol-5-yl)phenyl]phenyl]methyl]-5-ethyl-1,3,4-thiadiazol-2-amine CAS Name: N-[[4-[2-(1-butyl-5-tetrazolyl)phenyl]phenyl]methyl]-5-ethyl-1,3,4-thiadiazol-2-amine IUPAC Name: N-[[4-[2-(1-butyltetrazol-5-yl)phenyl]phenyl]methyl]-5-ethyl-1,3,4-thiadiazol-2-amine Traditional Name: [4-[2-(1-butyltetrazol-5-yl)phenyl]benzyl]-(5-ethyl-1,3,4-thiadiazol-2-yl)amine Formula: C22H25N7S MolecularWeight: 419.5458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)C2=CC=CC=C2C3=CC=C(C=C3)CNC4=NN=C(S4)CC

Isomeric SMILES

CCCCN1C(=NN=N1)C2=CC=CC=C2C3=CC=C(C=C3)CNC4=NN=C(S4)CC

InChI

InChI=1S/C22H25N7S/c1-3-5-14-29-21(25-27-28-29)19-9-7-6-8-18(19)17-12-10-16(11-13-17)15-23-22-26-24-20(4-2)30-22/h6-13H,3-5,14-15H2,1-2H3,(H,23,26)