1-(2-methylpropyl)-4-[(2-phenyl-1,3-thiazol-5-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-(2-methylpropyl)-4-[(2-phenyl-1,3-thiazol-5-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-isobutyl-4-[(2-phenylthiazol-5-yl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-(2-methylpropyl)-4-[(2-phenyl-5-thiazolyl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-(2-methylpropyl)-4-[(2-phenyl-1,3-thiazol-5-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-isobutyl-4-[(2-phenylthiazol-5-yl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)CC2=CN=C(S2)C3=CC=CC=C3)OCC4=CC=NC=C4

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)CC2=CN=C(S2)C3=CC=CC=C3)OCC4=CC=NC=C4

InChI

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