sodium (2Z)-5-methoxy-3-propan-2-yloxy-N-(2H-1,2,3,4-tetrazol-5-yl)-1-benzothiophene-2-carboximidate

Systemtic Name: sodium (2Z)-5-methoxy-3-propan-2-yloxy-N-(2H-1,2,3,4-tetrazol-5-yl)-1-benzothiophene-2-carboximidate Openeye Name: sodium (2Z)-3-isopropoxy-5-methoxy-N-(2H-tetrazol-5-yl)benzothiophene-2-carboximidate CAS Name: sodium (2Z)-5-methoxy-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-1-benzothiophene-2-carboximidate IUPAC Name: sodium (2Z)-5-methoxy-3-propan-2-yloxy-N-(2H-tetrazol-5-yl)-1-benzothiophene-2-carboximidate Traditional Name: sodium (2Z)-3-isopropoxy-5-methoxy-N-(2H-tetrazol-5-yl)benzothiophene-2-carboximidate Formula: C14H14N5NaO3S MolecularWeight: 355.34743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(SC2=C1C=C(C=C2)OC)C(=NC3=NNN=N3)[O-].[Na+]

Isomeric SMILES

CC(C)OC1=C(SC2=C1C=C(C=C2)OC)/C(=N/C3=NNN=N3)/[O-].[Na+]

InChI

InChI=1S/C14H15N5O3S.Na/c1-7(2)22-11-9-6-8(21-3)4-5-10(9)23-12(11)13(20)15-14-16-18-19-17-14;/h4-7H,1-3H3,(H2,15,16,17,18,19,20);/q;+1/p-1