[(2S)-7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(5-propan-2-yl-1,2-oxazol-3-yl)methanone

Systemtic Name: [(2S)-7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(5-propan-2-yl-1,2-oxazol-3-yl)methanone Openeye Name: (5-isopropylisoxazol-3-yl)-[(2S)-7-methyl-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone CAS Name: [(2S)-7-methyl-2-(3-thiophenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(5-propan-2-yl-3-isoxazolyl)methanone IUPAC Name: [(2S)-7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(5-propan-2-yl-1,2-oxazol-3-yl)methanone Traditional Name: (5-isopropylisoxazol-3-yl)-[(2S)-7-methyl-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(CN(C2)C(=O)C3=NOC(=C3)C(C)C)C4=CSC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)O[C@H](CN(C2)C(=O)C3=NOC(=C3)C(C)C)C4=CSC=C4

InChI

InChI=1S/C21H22N2O3S/c1-13(2)19-9-17(22-26-19)21(24)23-10-16-8-14(3)4-5-18(16)25-20(11-23)15-6-7-27-12-15/h4-9,12-13,20H,10-11H2,1-3H3/t20-/m1/s1