2-[2-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfinylethanoyl-quinolin-3-yl-amino]-N-cyclohexyl-2-thiophen-2-yl-ethanamide

Systemtic Name: 2-[2-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfinylethanoyl-quinolin-3-yl-amino]-N-cyclohexyl-2-thiophen-2-yl-ethanamide Openeye Name: 2-[[2-[2-(4-bromoanilino)-2-oxo-ethyl]sulfinylacetyl]-(3-quinolyl)amino]-N-cyclohexyl-2-(2-thienyl)acetamide CAS Name: 2-[[2-[2-(4-bromoanilino)-2-oxoethyl]sulfinyl-1-oxoethyl]-(3-quinolinyl)amino]-N-cyclohexyl-2-thiophen-2-ylacetamide IUPAC Name: 2-[[2-[2-(4-bromoanilino)-2-oxoethyl]sulfinylacetyl]-quinolin-3-ylamino]-N-cyclohexyl-2-thiophen-2-ylacetamide Traditional Name: 2-[[2-[2-(4-bromoanilino)-2-keto-ethyl]sulfinylacetyl]-(3-quinolyl)amino]-N-cyclohexyl-2-(2-thienyl)acetamide Formula: C31H31BrN4O4S2 MolecularWeight: 667.63624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=CS2)N(C3=CC4=CC=CC=C4N=C3)C(=O)CS(=O)CC(=O)NC5=CC=C(C=C5)Br

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC=CS2)N(C3=CC4=CC=CC=C4N=C3)C(=O)CS(=O)CC(=O)NC5=CC=C(C=C5)Br

InChI

InChI=1S/C31H31BrN4O4S2/c32-22-12-14-24(15-13-22)34-28(37)19-42(40)20-29(38)36(25-17-21-7-4-5-10-26(21)33-18-25)30(27-11-6-16-41-27)31(39)35-23-8-2-1-3-9-23/h4-7,10-18,23,30H,1-3,8-9,19-20H2,(H,34,37)(H,35,39)