N-(4-methyl-1,3-benzothiazol-2-yl)-1-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-[(5-phenyltetrazol-2-yl)methyl]pyrazole-3-carboxamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-[(5-phenyl-2-tetrazolyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-[(5-phenyltetrazol-2-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-[(5-phenyltetrazol-2-yl)methyl]pyrazole-3-carboxamide Formula: C20H16N8OS MolecularWeight: 416.45904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=NN(C=C3)CN4N=C(N=N4)C5=CC=CC=C5

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=NN(C=C3)CN4N=C(N=N4)C5=CC=CC=C5

InChI

InChI=1S/C20H16N8OS/c1-13-6-5-9-16-17(13)21-20(30-16)22-19(29)15-10-11-27(24-15)12-28-25-18(23-26-28)14-7-3-2-4-8-14/h2-11H,12H2,1H3,(H,21,22,29)