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

Systemtic Name: butyl N-[5-[(4-nitrophenyl)methyl]-1,3,4-thiadiazol-2-yl]carbamate Openeye Name: butyl N-[5-[(4-nitrophenyl)methyl]-1,3,4-thiadiazol-2-yl]carbamate CAS Name: N-[5-[(4-nitrophenyl)methyl]-1,3,4-thiadiazol-2-yl]carbamic acid butyl ester IUPAC Name: butyl N-[5-[(4-nitrophenyl)methyl]-1,3,4-thiadiazol-2-yl]carbamate Traditional Name: N-[5-(4-nitrobenzyl)-1,3,4-thiadiazol-2-yl]carbamic acid butyl ester Formula: C14H16N4O4S MolecularWeight: 336.36624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1=NN=C(S1)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)NC1=NN=C(S1)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O4S/c1-2-3-8-22-14(19)15-13-17-16-12(23-13)9-10-4-6-11(7-5-10)18(20)21/h4-7H,2-3,8-9H2,1H3,(H,15,17,19)