3-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-5,6-diphenyl-1,2,4-triazine

Systemtic Name: 3-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-5,6-diphenyl-1,2,4-triazine Openeye Name: 3-[(1-butyltetrazol-5-yl)methylsulfanyl]-5,6-diphenyl-1,2,4-triazine CAS Name: 3-[(1-butyl-5-tetrazolyl)methylthio]-5,6-diphenyl-1,2,4-triazine IUPAC Name: 3-[(1-butyltetrazol-5-yl)methylsulfanyl]-5,6-diphenyl-1,2,4-triazine Traditional Name: 3-[(1-butyltetrazol-5-yl)methylthio]-5,6-diphenyl-1,2,4-triazine Formula: C21H21N7S MolecularWeight: 403.50334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)CSC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=NN=N1)CSC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N7S/c1-2-3-14-28-18(23-26-27-28)15-29-21-22-19(16-10-6-4-7-11-16)20(24-25-21)17-12-8-5-9-13-17/h4-13H,2-3,14-15H2,1H3