2-methoxy-N-[4-methylsulfanyl-1-oxidanylidene-1-[(2-phenyl-2-pyrrolidin-1-yl-ethyl)amino]butan-2-yl]benzamide

Systemtic Name: 2-methoxy-N-[4-methylsulfanyl-1-oxidanylidene-1-[(2-phenyl-2-pyrrolidin-1-yl-ethyl)amino]butan-2-yl]benzamide Openeye Name: 2-methoxy-N-[3-methylsulfanyl-1-[(2-phenyl-2-pyrrolidin-1-yl-ethyl)carbamoyl]propyl]benzamide CAS Name: 2-methoxy-N-[4-(methylthio)-1-oxo-1-[[2-phenyl-2-(1-pyrrolidinyl)ethyl]amino]butan-2-yl]benzamide IUPAC Name: 2-methoxy-N-[4-methylsulfanyl-1-oxo-1-[(2-phenyl-2-pyrrolidin-1-ylethyl)amino]butan-2-yl]benzamide Traditional Name: 2-methoxy-N-[3-(methylthio)-1-[(2-phenyl-2-pyrrolidino-ethyl)carbamoyl]propyl]benzamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCC(C2=CC=CC=C2)N3CCCC3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCC(C2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C25H33N3O3S/c1-31-23-13-7-6-12-20(23)24(29)27-21(14-17-32-2)25(30)26-18-22(28-15-8-9-16-28)19-10-4-3-5-11-19/h3-7,10-13,21-22H,8-9,14-18H2,1-2H3,(H,26,30)(H,27,29)