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

Systemtic Name: 4-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-[(2-pyrimidin-2-ylthiazol-4-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-[[2-(2-pyrimidinyl)-4-thiazolyl]methyl]-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-[[2-(2-pyrimidyl)thiazol-4-yl]methyl]-3,5-dihydro-2H-1,4-benzoxazepine Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2CN1CC3=CSC(=N3)C4=NC=CC=N4

Isomeric SMILES

C1COC2=CC=CC=C2CN1CC3=CSC(=N3)C4=NC=CC=N4

InChI

InChI=1S/C17H16N4OS/c1-2-5-15-13(4-1)10-21(8-9-22-15)11-14-12-23-17(20-14)16-18-6-3-7-19-16/h1-7,12H,8-11H2