N-[3-(2-methylbutan-2-ylamino)-2-(4-methylphenyl)-3-oxidanylidene-1-thiophen-2-yl-propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[3-(2-methylbutan-2-ylamino)-2-(4-methylphenyl)-3-oxidanylidene-1-thiophen-2-yl-propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[3-(1,1-dimethylpropylamino)-3-oxo-2-(p-tolyl)-1-(2-thienyl)propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[3-(2-methylbutan-2-ylamino)-2-(4-methylphenyl)-3-oxo-1-thiophen-2-ylpropyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[3-(2-methylbutan-2-ylamino)-2-(4-methylphenyl)-3-oxo-1-thiophen-2-ylpropyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[3-(tert-amylamino)-3-keto-2-(p-tolyl)-1-(2-thienyl)propyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C28H32N2O4S MolecularWeight: 492.62968

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C(C1=CC=C(C=C1)C)C(C2=CC=CS2)NC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCC(C)(C)NC(=O)C(C1=CC=C(C=C1)C)C(C2=CC=CS2)NC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C28H32N2O4S/c1-5-28(3,4)30-27(32)24(19-10-8-18(2)9-11-19)25(23-7-6-16-35-23)29-26(31)20-12-13-21-22(17-20)34-15-14-33-21/h6-13,16-17,24-25H,5,14-15H2,1-4H3,(H,29,31)(H,30,32)