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

Systemtic Name: 1-[(4-methylsulfanylphenyl)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-methylsulfanylphenyl)carbamoylamino]cyclopentanecarboxamide CAS Name: 1-[[[4-(methylthio)anilino]-oxomethyl]amino]-N-[(2R)-1-[3-(4-morpholinyl)propylamino]-1-oxo-3-phenylpropan-2-yl]-1-cyclopentanecarboxamide IUPAC Name: 1-[(4-methylsulfanylphenyl)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-(methylthio)phenyl]carbamoylamino]cyclopentanecarboxamide Formula: C30H41N5O4S MolecularWeight: 567.74264

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)NC2(CCCC2)C(=O)NC(CC3=CC=CC=C3)C(=O)NCCCN4CCOCC4

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)NC2(CCCC2)C(=O)N[C@H](CC3=CC=CC=C3)C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C30H41N5O4S/c1-40-25-12-10-24(11-13-25)32-29(38)34-30(14-5-6-15-30)28(37)33-26(22-23-8-3-2-4-9-23)27(36)31-16-7-17-35-18-20-39-21-19-35/h2-4,8-13,26H,5-7,14-22H2,1H3,(H,31,36)(H,33,37)(H2,32,34,38)/t26-/m1/s1