(2S)-2-methyl-4-[(4-phenyl-1,3-thiazol-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: (2S)-2-methyl-4-[(4-phenyl-1,3-thiazol-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: (2S)-2-methyl-4-[(4-phenylthiazol-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: (2S)-2-methyl-4-[(4-phenyl-2-thiazolyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: (2S)-2-methyl-4-[(4-phenyl-1,3-thiazol-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: (2S)-2-methyl-4-[(4-phenylthiazol-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC2=CC=CC=C2O1)CC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1CN(CC2=CC=CC=C2O1)CC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H20N2OS/c1-15-11-22(12-17-9-5-6-10-19(17)23-15)13-20-21-18(14-24-20)16-7-3-2-4-8-16/h2-10,14-15H,11-13H2,1H3/t15-/m0/s1