N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-3-methylsulfanyl-4-oxidanylidene-6,7-dihydro-5H-2-benzothiophene-1-carboxamide

Systemtic Name: N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-3-methylsulfanyl-4-oxidanylidene-6,7-dihydro-5H-2-benzothiophene-1-carboxamide Openeye Name: N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-3-methylsulfanyl-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxamide CAS Name: N-[1-(3-methoxy-3-methylbutyl)-4-pyrazolyl]-3-(methylthio)-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxamide IUPAC Name: N-[1-(3-methoxy-3-methylbutyl)pyrazol-4-yl]-3-methylsulfanyl-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxamide Traditional Name: 4-keto-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-3-(methylthio)-6,7-dihydro-5H-isobenzothiophene-1-carboxamide Formula: C19H25N3O3S2 MolecularWeight: 407.5501

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C=C(C=N1)NC(=O)C2=C3CCCC(=O)C3=C(S2)SC)OC

Isomeric SMILES

CC(C)(CCN1C=C(C=N1)NC(=O)C2=C3CCCC(=O)C3=C(S2)SC)OC

InChI

InChI=1S/C19H25N3O3S2/c1-19(2,25-3)8-9-22-11-12(10-20-22)21-17(24)16-13-6-5-7-14(23)15(13)18(26-4)27-16/h10-11H,5-9H2,1-4H3,(H,21,24)