1-(2-oxidanylideneazepan-3-yl)-3-(1,3,4-thiadiazol-2-yl)urea

Systemtic Name: 1-(2-oxidanylideneazepan-3-yl)-3-(1,3,4-thiadiazol-2-yl)urea Openeye Name: 1-(2-oxoazepan-3-yl)-3-(1,3,4-thiadiazol-2-yl)urea CAS Name: 1-(2-oxo-3-azepanyl)-3-(1,3,4-thiadiazol-2-yl)urea IUPAC Name: 1-(2-oxoazepan-3-yl)-3-(1,3,4-thiadiazol-2-yl)urea Traditional Name: 1-(2-ketoazepan-3-yl)-3-(1,3,4-thiadiazol-2-yl)urea Formula: C9H13N5O2S MolecularWeight: 255.29682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)NC2=NN=CS2

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)NC2=NN=CS2

InChI

InChI=1S/C9H13N5O2S/c15-7-6(3-1-2-4-10-7)12-8(16)13-9-14-11-5-17-9/h5-6H,1-4H2,(H,10,15)(H2,12,13,14,16)