2-(4-propan-2-ylphenoxy)-N-[(2-propyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-propan-2-ylphenoxy)-N-[(2-propyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]ethanamide Openeye Name: 2-(4-isopropylphenoxy)-N-[(2-propyltetrazol-5-yl)carbamothioyl]acetamide CAS Name: 2-(4-propan-2-ylphenoxy)-N-[[(2-propyl-5-tetrazolyl)amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-propan-2-ylphenoxy)-N-[(2-propyltetrazol-5-yl)carbamothioyl]acetamide Traditional Name: 2-(4-isopropylphenoxy)-N-[(2-propyltetrazol-5-yl)thiocarbamoyl]acetamide Formula: C16H22N6O2S MolecularWeight: 362.44988

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1N=C(N=N1)NC(=S)NC(=O)COC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCCN1N=C(N=N1)NC(=S)NC(=O)COC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C16H22N6O2S/c1-4-9-22-20-15(19-21-22)18-16(25)17-14(23)10-24-13-7-5-12(6-8-13)11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H2,17,18,20,23,25)