2-methylpropyl N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamate

Systemtic Name: 2-methylpropyl N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamate Openeye Name: isobutyl N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamate CAS Name: N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamate Traditional Name: N-[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamic acid isobutyl ester Formula: C13H14N4O4S MolecularWeight: 322.33966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)NC1=NN=C(S1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)COC(=O)NC1=NN=C(S1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O4S/c1-8(2)7-21-13(18)14-12-16-15-11(22-12)9-4-3-5-10(6-9)17(19)20/h3-6,8H,7H2,1-2H3,(H,14,16,18)