1-(5-hexyl-1,3,4-thiadiazol-2-yl)-3-(4-nitrophenyl)urea

Systemtic Name: 1-(5-hexyl-1,3,4-thiadiazol-2-yl)-3-(4-nitrophenyl)urea Openeye Name: 1-(5-hexyl-1,3,4-thiadiazol-2-yl)-3-(4-nitrophenyl)urea CAS Name: 1-(5-hexyl-1,3,4-thiadiazol-2-yl)-3-(4-nitrophenyl)urea IUPAC Name: 1-(5-hexyl-1,3,4-thiadiazol-2-yl)-3-(4-nitrophenyl)urea Traditional Name: 1-(5-hexyl-1,3,4-thiadiazol-2-yl)-3-(4-nitrophenyl)urea Formula: C15H19N5O3S MolecularWeight: 349.40806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NN=C(S1)NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCC1=NN=C(S1)NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H19N5O3S/c1-2-3-4-5-6-13-18-19-15(24-13)17-14(21)16-11-7-9-12(10-8-11)20(22)23/h7-10H,2-6H2,1H3,(H2,16,17,19,21)