7-(3-methoxyphenyl)-5-methyl-5-thiophen-2-yl-1H-4,1-benzoxazepin-2-one

Systemtic Name: 7-(3-methoxyphenyl)-5-methyl-5-thiophen-2-yl-1H-4,1-benzoxazepin-2-one Openeye Name: 7-(3-methoxyphenyl)-5-methyl-5-(2-thienyl)-1H-4,1-benzoxazepin-2-one CAS Name: 7-(3-methoxyphenyl)-5-methyl-5-thiophen-2-yl-1H-4,1-benzoxazepin-2-one IUPAC Name: 7-(3-methoxyphenyl)-5-methyl-5-thiophen-2-yl-1H-4,1-benzoxazepin-2-one Traditional Name: 7-(3-methoxyphenyl)-5-methyl-5-(2-thienyl)-1H-4,1-benzoxazepin-2-one Formula: C21H19NO3S MolecularWeight: 365.44546

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CC(=CC=C3)OC)NC(=O)CO1)C4=CC=CS4

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CC(=CC=C3)OC)NC(=O)CO1)C4=CC=CS4

InChI

InChI=1S/C21H19NO3S/c1-21(19-7-4-10-26-19)17-12-15(14-5-3-6-16(11-14)24-2)8-9-18(17)22-20(23)13-25-21/h3-12H,13H2,1-2H3,(H,22,23)