pentyl N-[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]carbamate

Systemtic Name: pentyl N-[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]carbamate Openeye Name: pentyl N-[3-(5-thioxo-2H-tetrazol-1-yl)phenyl]carbamate CAS Name: N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]carbamic acid pentyl ester IUPAC Name: pentyl N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]carbamate Traditional Name: N-[3-(5-thioxo-2H-tetrazol-1-yl)phenyl]carbamic acid amyl ester Formula: C13H17N5O2S MolecularWeight: 307.37138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)NC1=CC=CC(=C1)N2C(=S)N=NN2

Isomeric SMILES

CCCCCOC(=O)NC1=CC=CC(=C1)N2C(=S)N=NN2

InChI

InChI=1S/C13H17N5O2S/c1-2-3-4-8-20-13(19)14-10-6-5-7-11(9-10)18-12(21)15-16-17-18/h5-7,9H,2-4,8H2,1H3,(H,14,19)(H,15,17,21)