5-methoxy-6-methyl-3-(4-propan-2-ylphenyl)sulfanyl-N-(2H-1,2,3,4-tetrazol-5-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-methoxy-6-methyl-3-(4-propan-2-ylphenyl)sulfanyl-N-(2H-1,2,3,4-tetrazol-5-yl)-1-benzothiophene-2-carboxamide Openeye Name: 3-(4-isopropylphenyl)sulfanyl-5-methoxy-6-methyl-N-(2H-tetrazol-5-yl)benzothiophene-2-carboxamide CAS Name: 5-methoxy-6-methyl-3-[(4-propan-2-ylphenyl)thio]-N-(2H-tetrazol-5-yl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-methoxy-6-methyl-3-(4-propan-2-ylphenyl)sulfanyl-N-(2H-tetrazol-5-yl)-1-benzothiophene-2-carboxamide Traditional Name: 5-methoxy-6-methyl-3-(p-cumenylthio)-N-(2H-tetrazol-5-yl)benzothiophene-2-carboxamide Formula: C21H21N5O2S2 MolecularWeight: 439.55374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)SC(=C2SC3=CC=C(C=C3)C(C)C)C(=O)NC4=NNN=N4)OC

Isomeric SMILES

CC1=C(C=C2C(=C1)SC(=C2SC3=CC=C(C=C3)C(C)C)C(=O)NC4=NNN=N4)OC

InChI

InChI=1S/C21H21N5O2S2/c1-11(2)13-5-7-14(8-6-13)29-18-15-10-16(28-4)12(3)9-17(15)30-19(18)20(27)22-21-23-25-26-24-21/h5-11H,1-4H3,(H2,22,23,24,25,26,27)