4-[(1,3-dimethylpyrazol-4-yl)methyl]-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol

Systemtic Name: 4-[(1,3-dimethylpyrazol-4-yl)methyl]-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 4-[(1,3-dimethylpyrazol-4-yl)methyl]-7-(2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 4-[(1,3-dimethyl-4-pyrazolyl)methyl]-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 4-[(1,3-dimethylpyrazol-4-yl)methyl]-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 4-[(1,3-dimethylpyrazol-4-yl)methyl]-7-(2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CN2CCOC3=C(C2)C=C(C=C3O)C4=CC=CS4)C

Isomeric SMILES

CC1=NN(C=C1CN2CCOC3=C(C2)C=C(C=C3O)C4=CC=CS4)C

InChI

InChI=1S/C19H21N3O2S/c1-13-16(10-21(2)20-13)12-22-5-6-24-19-15(11-22)8-14(9-17(19)23)18-4-3-7-25-18/h3-4,7-10,23H,5-6,11-12H2,1-2H3