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

Systemtic Name: N-methyl-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]-N-methyl-benzothiophene-2-carboxamide CAS Name: N-methyl-N-[1-[[[(2R)-1-[3-(4-morpholinyl)propylamino]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]cyclohexyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-methyl-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]-N-methyl-benzothiophene-2-carboxamide Formula: C33H42N4O4S MolecularWeight: 590.77598

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C1=CC2=CC=CC=C2S1)C3(CCCCC3)C(=O)NC(CC4=CC=CC=C4)C(=O)NCCCN5CCOCC5

Isomeric SMILES

CN(C(=O)C1=CC2=CC=CC=C2S1)C3(CCCCC3)C(=O)N[C@H](CC4=CC=CC=C4)C(=O)NCCCN5CCOCC5

InChI

InChI=1S/C33H42N4O4S/c1-36(31(39)29-24-26-13-6-7-14-28(26)42-29)33(15-8-3-9-16-33)32(40)35-27(23-25-11-4-2-5-12-25)30(38)34-17-10-18-37-19-21-41-22-20-37/h2,4-7,11-14,24,27H,3,8-10,15-23H2,1H3,(H,34,38)(H,35,40)/t27-/m1/s1