1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[3-(2-oxidanylideneazepan-1-yl)propyl]urea

Systemtic Name: 1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[3-(2-oxidanylideneazepan-1-yl)propyl]urea Openeye Name: 1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[3-(2-oxoazepan-1-yl)propyl]urea CAS Name: 1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[3-(2-oxo-1-azepanyl)propyl]urea IUPAC Name: 1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[3-(2-oxoazepan-1-yl)propyl]urea Traditional Name: 1-[3-(2-ketoazepan-1-yl)propyl]-3-(5-methyl-1,3,4-thiadiazol-2-yl)urea Formula: C13H21N5O2S MolecularWeight: 311.40314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)NCCCN2CCCCCC2=O

Isomeric SMILES

CC1=NN=C(S1)NC(=O)NCCCN2CCCCCC2=O

InChI

InChI=1S/C13H21N5O2S/c1-10-16-17-13(21-10)15-12(20)14-7-5-9-18-8-4-2-3-6-11(18)19/h2-9H2,1H3,(H2,14,15,17,20)