[7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-methylthiophen-2-yl)methanone

Systemtic Name: [7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-methylthiophen-2-yl)methanone Openeye Name: [7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-methyl-2-thienyl)methanone CAS Name: [7-(3,6-dimethyl-2-pyrazinyl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-methyl-2-thiophenyl)methanone IUPAC Name: [7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-methylthiophen-2-yl)methanone Traditional Name: [7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(3-methyl-2-thienyl)methanone Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=NC(=CN=C4C)C

Isomeric SMILES

CC1=C(SC=C1)C(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=NC(=CN=C4C)C

InChI

InChI=1S/C22H23N3O3S/c1-13-5-8-29-21(13)22(26)25-6-7-28-20-17(12-25)9-16(10-18(20)27-4)19-15(3)23-11-14(2)24-19/h5,8-11H,6-7,12H2,1-4H3