3-cyclohexylsulfanyl-5,6-dimethoxy-N-(2H-1,2,3,4-tetrazol-5-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-cyclohexylsulfanyl-5,6-dimethoxy-N-(2H-1,2,3,4-tetrazol-5-yl)-1-benzothiophene-2-carboxamide Openeye Name: 3-cyclohexylsulfanyl-5,6-dimethoxy-N-(2H-tetrazol-5-yl)benzothiophene-2-carboxamide CAS Name: 3-(cyclohexylthio)-5,6-dimethoxy-N-(2H-tetrazol-5-yl)-1-benzothiophene-2-carboxamide IUPAC Name: 3-cyclohexylsulfanyl-5,6-dimethoxy-N-(2H-tetrazol-5-yl)-1-benzothiophene-2-carboxamide Traditional Name: 3-(cyclohexylthio)-5,6-dimethoxy-N-(2H-tetrazol-5-yl)benzothiophene-2-carboxamide Formula: C18H21N5O3S2 MolecularWeight: 419.52104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(S2)C(=O)NC3=NNN=N3)SC4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(S2)C(=O)NC3=NNN=N3)SC4CCCCC4)OC

InChI

InChI=1S/C18H21N5O3S2/c1-25-12-8-11-14(9-13(12)26-2)28-16(17(24)19-18-20-22-23-21-18)15(11)27-10-6-4-3-5-7-10/h8-10H,3-7H2,1-2H3,(H2,19,20,21,22,23,24)