1-(2-methylpropyl)-4-[(4-phenyl-1,3-thiazol-2-yl)methyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-(2-methylpropyl)-4-[(4-phenyl-1,3-thiazol-2-yl)methyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-isobutyl-4-[(4-phenylthiazol-2-yl)methyl]-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-(2-methylpropyl)-4-[(4-phenyl-2-thiazolyl)methyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-(2-methylpropyl)-4-[(4-phenyl-1,3-thiazol-2-yl)methyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-isobutyl-4-[(4-phenylthiazol-2-yl)methyl]-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C25H30N4O2S MolecularWeight: 450.5963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)CC2=NC(=CS2)C3=CC=CC=C3)OCC4=CN=CC=C4

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)CC2=NC(=CS2)C3=CC=CC=C3)OCC4=CN=CC=C4

InChI

InChI=1S/C25H30N4O2S/c1-19(2)12-29-14-22(31-17-20-7-6-10-26-11-20)13-28(16-25(29)30)15-24-27-23(18-32-24)21-8-4-3-5-9-21/h3-11,18-19,22H,12-17H2,1-2H3