4-[[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-2-pyridin-3-yl-quinazoline

Systemtic Name: 4-[[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-2-pyridin-3-yl-quinazoline Openeye Name: 4-(1-benzyltetrazol-5-yl)sulfanyl-2-(3-pyridyl)quinazoline CAS Name: 4-[[1-(phenylmethyl)-5-tetrazolyl]thio]-2-(3-pyridinyl)quinazoline IUPAC Name: 4-(1-benzyltetrazol-5-yl)sulfanyl-2-pyridin-3-ylquinazoline Traditional Name: 4-[(1-benzyltetrazol-5-yl)thio]-2-(3-pyridyl)quinazoline Formula: C21H15N7S MolecularWeight: 397.4557

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=N2)SC3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=N2)SC3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C21H15N7S/c1-2-7-15(8-3-1)14-28-21(25-26-27-28)29-20-17-10-4-5-11-18(17)23-19(24-20)16-9-6-12-22-13-16/h1-13H,14H2