2-[2-[2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl]oxybutanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-[2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl]oxybutanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[2-[4-oxo-2-(p-tolyl)chromen-3-yl]oxybutanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-[[2-(4-methylphenyl)-4-oxo-1-benzopyran-3-yl]oxy]-1-oxobutyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[2-[2-(4-methylphenyl)-4-oxochromen-3-yl]oxybutanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[2-[4-keto-2-(p-tolyl)chromen-3-yl]oxybutanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C29H28N2O5S MolecularWeight: 516.60802

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)N)OC3=C(OC4=CC=CC=C4C3=O)C5=CC=C(C=C5)C

Isomeric SMILES

CCC(C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)N)OC3=C(OC4=CC=CC=C4C3=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C29H28N2O5S/c1-3-20(28(34)31-29-23(27(30)33)19-9-5-7-11-22(19)37-29)35-26-24(32)18-8-4-6-10-21(18)36-25(26)17-14-12-16(2)13-15-17/h4,6,8,10,12-15,20H,3,5,7,9,11H2,1-2H3,(H2,30,33)(H,31,34)