[9-but-3-ynoxy-7-(5-methylthiophen-2-yl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(2-methyl-1,3-thiazol-4-yl)methanone

Systemtic Name: [9-but-3-ynoxy-7-(5-methylthiophen-2-yl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(2-methyl-1,3-thiazol-4-yl)methanone Openeye Name: [9-but-3-ynoxy-7-(5-methyl-2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(2-methylthiazol-4-yl)methanone CAS Name: [9-but-3-ynoxy-7-(5-methyl-2-thiophenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(2-methyl-4-thiazolyl)methanone IUPAC Name: [9-but-3-ynoxy-7-(5-methylthiophen-2-yl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(2-methyl-1,3-thiazol-4-yl)methanone Traditional Name: [9-but-3-ynoxy-7-(5-methyl-2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(2-methylthiazol-4-yl)methanone Formula: C23H22N2O3S2 MolecularWeight: 438.56238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=CC3=C(C(=C2)OCCC#C)OCCN(C3)C(=O)C4=CSC(=N4)C

Isomeric SMILES

CC1=CC=C(S1)C2=CC3=C(C(=C2)OCCC#C)OCCN(C3)C(=O)C4=CSC(=N4)C

InChI

InChI=1S/C23H22N2O3S2/c1-4-5-9-27-20-12-17(21-7-6-15(2)30-21)11-18-13-25(8-10-28-22(18)20)23(26)19-14-29-16(3)24-19/h1,6-7,11-12,14H,5,8-10,13H2,2-3H3