N'-methyl-N-[3-[1-[3-(phenylcarbonyl)phenyl]ethyl]-1,2-thiazol-5-yl]morpholine-4-carboximidamide

Systemtic Name: N'-methyl-N-[3-[1-[3-(phenylcarbonyl)phenyl]ethyl]-1,2-thiazol-5-yl]morpholine-4-carboximidamide Openeye Name: N-[3-[1-(3-benzoylphenyl)ethyl]isothiazol-5-yl]-N'-methyl-morpholine-4-carboxamidine CAS Name: N-[3-[1-(3-benzoylphenyl)ethyl]-5-isothiazolyl]-N'-methyl-4-morpholinecarboximidamide IUPAC Name: N-[3-[1-(3-benzoylphenyl)ethyl]-1,2-thiazol-5-yl]-N'-methylmorpholine-4-carboximidamide Traditional Name: N-[3-[1-(3-benzoylphenyl)ethyl]isothiazol-5-yl]-N'-methyl-morpholine-4-carboxamidine Formula: C24H26N4O2S MolecularWeight: 434.55384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C3=NSC(=C3)NC(=NC)N4CCOCC4

Isomeric SMILES

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C3=NSC(=C3)NC(=NC)N4CCOCC4

InChI

InChI=1S/C24H26N4O2S/c1-17(19-9-6-10-20(15-19)23(29)18-7-4-3-5-8-18)21-16-22(31-27-21)26-24(25-2)28-11-13-30-14-12-28/h3-10,15-17H,11-14H2,1-2H3,(H,25,26)