1-phenyl-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]phthalazine

Systemtic Name: 1-phenyl-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]phthalazine Openeye Name: 1-phenyl-4-(1-phenyltetrazol-5-yl)sulfanyl-phthalazine CAS Name: 1-phenyl-4-[(1-phenyl-5-tetrazolyl)thio]phthalazine IUPAC Name: 1-phenyl-4-(1-phenyltetrazol-5-yl)sulfanylphthalazine Traditional Name: 1-phenyl-4-[(1-phenyltetrazol-5-yl)thio]phthalazine Formula: C21H14N6S MolecularWeight: 382.44106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SC4=NN=NN4C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SC4=NN=NN4C5=CC=CC=C5

InChI

InChI=1S/C21H14N6S/c1-3-9-15(10-4-1)19-17-13-7-8-14-18(17)20(23-22-19)28-21-24-25-26-27(21)16-11-5-2-6-12-16/h1-14H