2-[2-(4,6,8-trimethyl-2-oxidanylidene-quinolin-1-yl)butanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-(4,6,8-trimethyl-2-oxidanylidene-quinolin-1-yl)butanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[2-(4,6,8-trimethyl-2-oxo-1-quinolyl)butanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[1-oxo-2-(4,6,8-trimethyl-2-oxo-1-quinolinyl)butyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[2-(4,6,8-trimethyl-2-oxoquinolin-1-yl)butanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[2-(2-keto-4,6,8-trimethyl-1-quinolyl)butanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)N)N3C(=O)C=C(C4=CC(=CC(=C43)C)C)C

Isomeric SMILES

CCC(C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)N)N3C(=O)C=C(C4=CC(=CC(=C43)C)C)C

InChI

InChI=1S/C25H29N3O3S/c1-5-18(28-20(29)12-14(3)17-11-13(2)10-15(4)22(17)28)24(31)27-25-21(23(26)30)16-8-6-7-9-19(16)32-25/h10-12,18H,5-9H2,1-4H3,(H2,26,30)(H,27,31)