N-[2-[(2S)-2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]pyrazine-2-carboxamide

Systemtic Name: N-[2-[(2S)-2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]pyrazine-2-carboxamide Openeye Name: N-[2-[(2S)-2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]pyrazine-2-carboxamide CAS Name: N-[2-[(2S)-2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-2-pyrazinecarboxamide IUPAC Name: N-[2-[(2S)-2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]pyrazine-2-carboxamide Traditional Name: N-[2-[(2S)-2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]pyrazinamide Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC2=C(O1)C=CC(=C2)C)CCNC(=O)C3=NC=CN=C3

Isomeric SMILES

C[C@H]1CN(CC2=C(O1)C=CC(=C2)C)CCNC(=O)C3=NC=CN=C3

InChI

InChI=1S/C18H22N4O2/c1-13-3-4-17-15(9-13)12-22(11-14(2)24-17)8-7-21-18(23)16-10-19-5-6-20-16/h3-6,9-10,14H,7-8,11-12H2,1-2H3,(H,21,23)/t14-/m0/s1