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

Systemtic Name: N-[1-[[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]cyclopropyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[1-[[(1R)-1-benzyl-2-(3-morpholinopropylamino)-2-oxo-ethyl]carbamoyl]cyclopropyl]benzothiophene-2-carboxamide CAS Name: N-[1-[[[(2R)-1-[3-(4-morpholinyl)propylamino]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]cyclopropyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[1-[[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]cyclopropyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[1-[[(1R)-1-benzyl-2-keto-2-(3-morpholinopropylamino)ethyl]carbamoyl]cyclopropyl]benzothiophene-2-carboxamide Formula: C29H34N4O4S MolecularWeight: 534.66966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C(=O)NC(CC2=CC=CC=C2)C(=O)NCCCN3CCOCC3)NC(=O)C4=CC5=CC=CC=C5S4

Isomeric SMILES

C1CC1(C(=O)N[C@H](CC2=CC=CC=C2)C(=O)NCCCN3CCOCC3)NC(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C29H34N4O4S/c34-26(30-13-6-14-33-15-17-37-18-16-33)23(19-21-7-2-1-3-8-21)31-28(36)29(11-12-29)32-27(35)25-20-22-9-4-5-10-24(22)38-25/h1-5,7-10,20,23H,6,11-19H2,(H,30,34)(H,31,36)(H,32,35)/t23-/m1/s1