[(4S)-2,2-dimethyloxan-4-yl]-(9-methoxy-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)methanone

Systemtic Name: [(4S)-2,2-dimethyloxan-4-yl]-(9-methoxy-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)methanone Openeye Name: [(4S)-2,2-dimethyltetrahydropyran-4-yl]-[9-methoxy-7-(2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone CAS Name: [(4S)-2,2-dimethyl-4-oxanyl]-(9-methoxy-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)methanone IUPAC Name: [(4S)-2,2-dimethyloxan-4-yl]-(9-methoxy-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)methanone Traditional Name: [(4S)-2,2-dimethyltetrahydropyran-4-yl]-[9-methoxy-7-(2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)C(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=CC=CS4)C

Isomeric SMILES

CC1(C[C@H](CCO1)C(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=CC=CS4)C

InChI

InChI=1S/C22H27NO4S/c1-22(2)13-15(6-8-27-22)21(24)23-7-9-26-20-17(14-23)11-16(12-18(20)25-3)19-5-4-10-28-19/h4-5,10-12,15H,6-9,13-14H2,1-3H3/t15-/m0/s1