6-bromanyl-N-[1-[[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]cyclohexyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 6-bromanyl-N-[1-[[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]cyclohexyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[1-[[(1R)-1-benzyl-2-(3-morpholinopropylamino)-2-oxo-ethyl]carbamoyl]cyclohexyl]-6-bromo-benzothiophene-2-carboxamide CAS Name: 6-bromo-N-[1-[[[(2R)-1-[3-(4-morpholinyl)propylamino]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]cyclohexyl]-1-benzothiophene-2-carboxamide IUPAC Name: 6-bromo-N-[1-[[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]cyclohexyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[1-[[(1R)-1-benzyl-2-keto-2-(3-morpholinopropylamino)ethyl]carbamoyl]cyclohexyl]-6-bromo-benzothiophene-2-carboxamide Formula: C32H39BrN4O4S MolecularWeight: 655.64546

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NC(CC2=CC=CC=C2)C(=O)NCCCN3CCOCC3)NC(=O)C4=CC5=C(S4)C=C(C=C5)Br

Isomeric SMILES

C1CCC(CC1)(C(=O)N[C@H](CC2=CC=CC=C2)C(=O)NCCCN3CCOCC3)NC(=O)C4=CC5=C(S4)C=C(C=C5)Br

InChI

InChI=1S/C32H39BrN4O4S/c33-25-11-10-24-21-28(42-27(24)22-25)30(39)36-32(12-5-2-6-13-32)31(40)35-26(20-23-8-3-1-4-9-23)29(38)34-14-7-15-37-16-18-41-19-17-37/h1,3-4,8-11,21-22,26H,2,5-7,12-20H2,(H,34,38)(H,35,40)(H,36,39)/t26-/m1/s1