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

Systemtic Name: 1,5-dithiocan-3-yl N-[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]carbamate Openeye Name: 1,5-dithiocan-3-yl N-[3-(5-thioxo-2H-tetrazol-1-yl)phenyl]carbamate CAS Name: N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]carbamic acid 1,5-dithiocan-3-yl ester IUPAC Name: 1,5-dithiocan-3-yl N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]carbamate Traditional Name: N-[3-(5-thioxo-2H-tetrazol-1-yl)phenyl]carbamic acid 1,5-dithiocan-3-yl ester Formula: C14H17N5O2S3 MolecularWeight: 383.51208

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC(CSC1)OC(=O)NC2=CC=CC(=C2)N3C(=S)N=NN3

Isomeric SMILES

C1CSCC(CSC1)OC(=O)NC2=CC=CC(=C2)N3C(=S)N=NN3

InChI

InChI=1S/C14H17N5O2S3/c20-14(21-12-8-23-5-2-6-24-9-12)15-10-3-1-4-11(7-10)19-13(22)16-17-18-19/h1,3-4,7,12H,2,5-6,8-9H2,(H,15,20)(H,16,18,22)