1-[(4-bromanyl-3-methyl-phenyl)carbamoylamino]-N-[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]cyclopentane-1-carboxamide

Systemtic Name: 1-[(4-bromanyl-3-methyl-phenyl)carbamoylamino]-N-[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]cyclopentane-1-carboxamide Openeye Name: N-[(1R)-1-benzyl-2-(3-morpholinopropylamino)-2-oxo-ethyl]-1-[(4-bromo-3-methyl-phenyl)carbamoylamino]cyclopentanecarboxamide CAS Name: 1-[[(4-bromo-3-methylanilino)-oxomethyl]amino]-N-[(2R)-1-[3-(4-morpholinyl)propylamino]-1-oxo-3-phenylpropan-2-yl]-1-cyclopentanecarboxamide IUPAC Name: 1-[(4-bromo-3-methylphenyl)carbamoylamino]-N-[(2R)-1-(3-morpholin-4-ylpropylamino)-1-oxo-3-phenylpropan-2-yl]cyclopentane-1-carboxamide Traditional Name: N-[(1R)-1-benzyl-2-keto-2-(3-morpholinopropylamino)ethyl]-1-[(4-bromo-3-methyl-phenyl)carbamoylamino]cyclopentanecarboxamide Formula: C30H40BrN5O4 MolecularWeight: 614.5737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)NC2(CCCC2)C(=O)NC(CC3=CC=CC=C3)C(=O)NCCCN4CCOCC4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)NC2(CCCC2)C(=O)N[C@H](CC3=CC=CC=C3)C(=O)NCCCN4CCOCC4)Br

InChI

InChI=1S/C30H40BrN5O4/c1-22-20-24(10-11-25(22)31)33-29(39)35-30(12-5-6-13-30)28(38)34-26(21-23-8-3-2-4-9-23)27(37)32-14-7-15-36-16-18-40-19-17-36/h2-4,8-11,20,26H,5-7,12-19,21H2,1H3,(H,32,37)(H,34,38)(H2,33,35,39)/t26-/m1/s1