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

Systemtic Name: 7-methyl-N-[1-[[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]cyclopentyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[1-[[(1R)-1-benzyl-2-(3-morpholinopropylamino)-2-oxo-ethyl]carbamoyl]cyclopentyl]-7-methyl-benzothiophene-2-carboxamide CAS Name: 7-methyl-N-[1-[[[(2R)-1-[3-(4-morpholinyl)propylamino]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]cyclopentyl]-1-benzothiophene-2-carboxamide IUPAC Name: 7-methyl-N-[1-[[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]cyclopentyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[1-[[(1R)-1-benzyl-2-keto-2-(3-morpholinopropylamino)ethyl]carbamoyl]cyclopentyl]-7-methyl-benzothiophene-2-carboxamide Formula: C32H40N4O4S MolecularWeight: 576.7494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1SC(=C2)C(=O)NC3(CCCC3)C(=O)NC(CC4=CC=CC=C4)C(=O)NCCCN5CCOCC5

Isomeric SMILES

CC1=CC=CC2=C1SC(=C2)C(=O)NC3(CCCC3)C(=O)N[C@H](CC4=CC=CC=C4)C(=O)NCCCN5CCOCC5

InChI

InChI=1S/C32H40N4O4S/c1-23-9-7-12-25-22-27(41-28(23)25)30(38)35-32(13-5-6-14-32)31(39)34-26(21-24-10-3-2-4-11-24)29(37)33-15-8-16-36-17-19-40-20-18-36/h2-4,7,9-12,22,26H,5-6,8,13-21H2,1H3,(H,33,37)(H,34,39)(H,35,38)/t26-/m1/s1