4-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(2-morpholin-4-ylethyl)-1,4-diazepane-1-carbothioamide

Systemtic Name: 4-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(2-morpholin-4-ylethyl)-1,4-diazepane-1-carbothioamide Openeye Name: 4-[(5-methylisoxazol-3-yl)methyl]-N-(2-morpholinoethyl)-1,4-diazepane-1-carbothioamide CAS Name: 4-[(5-methyl-3-isoxazolyl)methyl]-N-[2-(4-morpholinyl)ethyl]-1,4-diazepane-1-carbothioamide IUPAC Name: 4-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(2-morpholin-4-ylethyl)-1,4-diazepane-1-carbothioamide Traditional Name: 4-[(5-methylisoxazol-3-yl)methyl]-N-(2-morpholinoethyl)-1,4-diazepane-1-carbothioamide Formula: C17H29N5O2S MolecularWeight: 367.50946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN2CCCN(CC2)C(=S)NCCN3CCOCC3

Isomeric SMILES

CC1=CC(=NO1)CN2CCCN(CC2)C(=S)NCCN3CCOCC3

InChI

InChI=1S/C17H29N5O2S/c1-15-13-16(19-24-15)14-21-4-2-5-22(8-7-21)17(25)18-3-6-20-9-11-23-12-10-20/h13H,2-12,14H2,1H3,(H,18,25)