N-(2-methoxyphenyl)-2-[(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl-propyl-amino]ethanamide

Systemtic Name: N-(2-methoxyphenyl)-2-[(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl-propyl-amino]ethanamide Openeye Name: N-(2-methoxyphenyl)-2-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl-propyl-amino]acetamide CAS Name: N-(2-methoxyphenyl)-2-[(4-phenyl-5-sulfanylidene-1-tetrazolyl)methyl-propylamino]acetamide IUPAC Name: N-(2-methoxyphenyl)-2-[(4-phenyl-5-sulfanylidenetetrazol-1-yl)methyl-propylamino]acetamide Traditional Name: N-(2-methoxyphenyl)-2-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl-propyl-amino]acetamide Formula: C20H24N6O2S MolecularWeight: 412.50856

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1OC)CN2C(=S)N(N=N2)C3=CC=CC=C3

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1OC)CN2C(=S)N(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C20H24N6O2S/c1-3-13-24(14-19(27)21-17-11-7-8-12-18(17)28-2)15-25-20(29)26(23-22-25)16-9-5-4-6-10-16/h4-12H,3,13-15H2,1-2H3,(H,21,27)