5-chloranyl-1-[(1R)-1-cyclopropyl-2-methoxy-ethyl]-3-[(2,5-dimethyl-4-phenylmethoxy-phenyl)amino]pyrazin-2-one

Systemtic Name: 5-chloranyl-1-[(1R)-1-cyclopropyl-2-methoxy-ethyl]-3-[(2,5-dimethyl-4-phenylmethoxy-phenyl)amino]pyrazin-2-one Openeye Name: 3-(4-benzyloxy-2,5-dimethyl-anilino)-5-chloro-1-[(1R)-1-cyclopropyl-2-methoxy-ethyl]pyrazin-2-one CAS Name: 5-chloro-1-[(1R)-1-cyclopropyl-2-methoxyethyl]-3-(2,5-dimethyl-4-phenylmethoxyanilino)-2-pyrazinone IUPAC Name: 5-chloro-1-[(1R)-1-cyclopropyl-2-methoxyethyl]-3-(2,5-dimethyl-4-phenylmethoxyanilino)pyrazin-2-one Traditional Name: 3-(4-benzoxy-2,5-dimethyl-anilino)-5-chloro-1-[(1R)-1-cyclopropyl-2-methoxy-ethyl]pyrazin-2-one Formula: C25H28ClN3O3 MolecularWeight: 453.96112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OCC2=CC=CC=C2)C)NC3=NC(=CN(C3=O)C(COC)C4CC4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1OCC2=CC=CC=C2)C)NC3=NC(=CN(C3=O)[C@@H](COC)C4CC4)Cl

InChI

InChI=1S/C25H28ClN3O3/c1-16-12-22(32-14-18-7-5-4-6-8-18)17(2)11-20(16)27-24-25(30)29(13-23(26)28-24)21(15-31-3)19-9-10-19/h4-8,11-13,19,21H,9-10,14-15H2,1-3H3,(H,27,28)/t21-/m0/s1