N-(3,4-diethoxyphenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-(3,4-diethoxyphenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(3,4-diethoxyphenyl)-2-(1-phenyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-(3,4-diethoxyphenyl)-2-[(1-phenyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(3,4-diethoxyphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(3,4-diethoxyphenyl)-2-[(1-phenyltetrazol-5-yl)thio]acetamide Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NN=NN2C3=CC=CC=C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NN=NN2C3=CC=CC=C3)OCC

InChI

InChI=1S/C19H21N5O3S/c1-3-26-16-11-10-14(12-17(16)27-4-2)20-18(25)13-28-19-21-22-23-24(19)15-8-6-5-7-9-15/h5-12H,3-4,13H2,1-2H3,(H,20,25)