1-phenethyl-6-(pyridin-4-ylmethoxy)-4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 1-phenethyl-6-(pyridin-4-ylmethoxy)-4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-2-one Openeye Name: 1-phenethyl-6-(4-pyridylmethoxy)-4-(thiazol-2-ylmethyl)-1,4-diazepan-2-one CAS Name: 1-phenethyl-6-(pyridin-4-ylmethoxy)-4-(2-thiazolylmethyl)-1,4-diazepan-2-one IUPAC Name: 1-phenethyl-6-(pyridin-4-ylmethoxy)-4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-2-one Traditional Name: 1-phenethyl-6-(4-pyridylmethoxy)-4-(thiazol-2-ylmethyl)-1,4-diazepan-2-one Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C(=O)CN1CC2=NC=CS2)CCC3=CC=CC=C3)OCC4=CC=NC=C4

Isomeric SMILES

C1C(CN(C(=O)CN1CC2=NC=CS2)CCC3=CC=CC=C3)OCC4=CC=NC=C4

InChI

InChI=1S/C23H26N4O2S/c28-23-17-26(16-22-25-11-13-30-22)14-21(29-18-20-6-9-24-10-7-20)15-27(23)12-8-19-4-2-1-3-5-19/h1-7,9-11,13,21H,8,12,14-18H2