2-[[5-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-2-yl]methyl]-1,3-benzothiazole

Systemtic Name: 2-[[5-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-2-yl]methyl]-1,3-benzothiazole Openeye Name: 2-[[5-(4-isopropylphenyl)tetrazol-2-yl]methyl]-1,3-benzothiazole CAS Name: 2-[[5-(4-propan-2-ylphenyl)-2-tetrazolyl]methyl]-1,3-benzothiazole IUPAC Name: 2-[[5-(4-propan-2-ylphenyl)tetrazol-2-yl]methyl]-1,3-benzothiazole Traditional Name: 2-[(5-p-cumenyltetrazol-2-yl)methyl]-1,3-benzothiazole Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NN(N=N2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NN(N=N2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H17N5S/c1-12(2)13-7-9-14(10-8-13)18-20-22-23(21-18)11-17-19-15-5-3-4-6-16(15)24-17/h3-10,12H,11H2,1-2H3