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

Systemtic Name: N-[1-[[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]cyclopent-3-en-1-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-[1-[[(1R)-1-benzyl-2-(3-morpholinopropylamino)-2-oxo-ethyl]carbamoyl]cyclopent-3-en-1-yl]benzothiophene-2-carboxamide CAS Name: N-[1-[[[(2R)-1-[3-(4-morpholinyl)propylamino]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-1-cyclopent-3-enyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[1-[[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]cyclopent-3-en-1-yl]-1-benzothiophene-2-carboxamide Traditional Name: N-[1-[[(1R)-1-benzyl-2-keto-2-(3-morpholinopropylamino)ethyl]carbamoyl]cyclopent-3-en-1-yl]benzothiophene-2-carboxamide Formula: C31H36N4O4S MolecularWeight: 560.70694

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)C(CC2=CC=CC=C2)NC(=O)C3(CC=CC3)NC(=O)C4=CC5=CC=CC=C5S4

Isomeric SMILES

C1COCCN1CCCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)C3(CC=CC3)NC(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C31H36N4O4S/c36-28(32-15-8-16-35-17-19-39-20-18-35)25(21-23-9-2-1-3-10-23)33-30(38)31(13-6-7-14-31)34-29(37)27-22-24-11-4-5-12-26(24)40-27/h1-7,9-12,22,25H,8,13-21H2,(H,32,36)(H,33,38)(H,34,37)/t25-/m1/s1