1-(2-methoxyphenyl)-3-[5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1-(2-methoxyphenyl)-3-[5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-(2-methoxyphenyl)-3-[5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-(2-methoxyphenyl)-3-[5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(2-methoxyphenyl)-3-[5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-(2-methoxyphenyl)-3-[5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea Formula: C17H15N5O5S MolecularWeight: 401.3965

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)NC2=NN=C(S2)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NC(=O)NC2=NN=C(S2)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O5S/c1-26-14-5-3-2-4-13(14)18-16(23)19-17-21-20-15(28-17)10-27-12-8-6-11(7-9-12)22(24)25/h2-9H,10H2,1H3,(H2,18,19,21,23)