4-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoyl]-1-(oxan-4-ylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoyl]-1-(oxan-4-ylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]-6-(4-pyridylmethoxy)-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one CAS Name: 4-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-1-oxoethyl]-1-(4-oxanylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]-1-(oxan-4-ylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]acetyl]-6-(4-pyridylmethoxy)-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one Formula: C22H29N5O4S2 MolecularWeight: 491.62676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SCC(=O)N2CC(CN(C(=O)C2)CC3CCOCC3)OCC4=CC=NC=C4

Isomeric SMILES

CC1=NN=C(S1)SCC(=O)N2CC(CN(C(=O)C2)CC3CCOCC3)OCC4=CC=NC=C4

InChI

InChI=1S/C22H29N5O4S2/c1-16-24-25-22(33-16)32-15-21(29)27-12-19(31-14-18-2-6-23-7-3-18)11-26(20(28)13-27)10-17-4-8-30-9-5-17/h2-3,6-7,17,19H,4-5,8-15H2,1H3