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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=NC(=CN=C4C)C

Isomeric SMILES

CC1=CC=C(S1)C(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=NC(=CN=C4C)C

InChI

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