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

Systemtic Name: 4-(furan-3-ylmethyl)-1-[(2-methyl-1,3-thiazol-4-yl)methyl]-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(3-furylmethyl)-1-[(2-methylthiazol-4-yl)methyl]-6-(2-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-(3-furanylmethyl)-1-[(2-methyl-4-thiazolyl)methyl]-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(furan-3-ylmethyl)-1-[(2-methyl-1,3-thiazol-4-yl)methyl]-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(3-furfuryl)-1-[(2-methylthiazol-4-yl)methyl]-6-(2-pyridylmethoxy)-1,4-diazepan-2-one Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CC(CN(CC2=O)CC3=COC=C3)OCC4=CC=CC=N4

Isomeric SMILES

CC1=NC(=CS1)CN2CC(CN(CC2=O)CC3=COC=C3)OCC4=CC=CC=N4

InChI

InChI=1S/C21H24N4O3S/c1-16-23-19(15-29-16)9-25-11-20(28-14-18-4-2-3-6-22-18)10-24(12-21(25)26)8-17-5-7-27-13-17/h2-7,13,15,20H,8-12,14H2,1H3