N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide Formula: C25H23N3O3S2 MolecularWeight: 477.59842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC5=CC=CC=C54)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC5=CC=CC=C54)C#N

InChI

InChI=1S/C25H23N3O3S2/c26-16-21-20-11-2-4-13-23(20)32-25(21)27-24(29)18-8-5-10-19(15-18)33(30,31)28-14-6-9-17-7-1-3-12-22(17)28/h1,3,5,7-8,10,12,15H,2,4,6,9,11,13-14H2,(H,27,29)