dodecyl N-(5-methylbenzotriazol-1-yl)carbothioylcarbamate

Systemtic Name: dodecyl N-(5-methylbenzotriazol-1-yl)carbothioylcarbamate Openeye Name: dodecyl N-(5-methylbenzotriazole-1-carbothioyl)carbamate CAS Name: N-[(5-methyl-1-benzotriazolyl)-sulfanylidenemethyl]carbamic acid dodecyl ester IUPAC Name: dodecyl N-(5-methylbenzotriazole-1-carbothioyl)carbamate Traditional Name: N-(5-methylbenzotriazole-1-carbothioyl)carbamic acid lauryl ester Formula: C21H32N4O2S MolecularWeight: 404.56938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)NC(=S)N1C2=C(C=C(C=C2)C)N=N1

Isomeric SMILES

CCCCCCCCCCCCOC(=O)NC(=S)N1C2=C(C=C(C=C2)C)N=N1

InChI

InChI=1S/C21H32N4O2S/c1-3-4-5-6-7-8-9-10-11-12-15-27-21(26)22-20(28)25-19-14-13-17(2)16-18(19)23-24-25/h13-14,16H,3-12,15H2,1-2H3,(H,22,26,28)