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

Systemtic Name: N-[2-methyl-1-[[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-propan-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-[2-[[(1R)-1-benzyl-2-(3-morpholinopropylamino)-2-oxo-ethyl]amino]-1,1-dimethyl-2-oxo-ethyl]benzothiophene-2-carboxamide CAS Name: N-[2-methyl-1-[[(2R)-1-[3-(4-morpholinyl)propylamino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-methyl-1-[[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: N-[2-[[(1R)-1-benzyl-2-keto-2-(3-morpholinopropylamino)ethyl]amino]-2-keto-1,1-dimethyl-ethyl]benzothiophene-2-carboxamide Formula: C29H36N4O4S MolecularWeight: 536.68554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC(CC1=CC=CC=C1)C(=O)NCCCN2CCOCC2)NC(=O)C3=CC4=CC=CC=C4S3

Isomeric SMILES

CC(C)(C(=O)N[C@H](CC1=CC=CC=C1)C(=O)NCCCN2CCOCC2)NC(=O)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C29H36N4O4S/c1-29(2,32-27(35)25-20-22-11-6-7-12-24(22)38-25)28(36)31-23(19-21-9-4-3-5-10-21)26(34)30-13-8-14-33-15-17-37-18-16-33/h3-7,9-12,20,23H,8,13-19H2,1-2H3,(H,30,34)(H,31,36)(H,32,35)/t23-/m1/s1