N-(2,4-dimethoxyphenyl)-2-(3-methyl-6-sulfanylidene-1,2,4,5-tetrazinan-3-yl)ethanamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-2-(3-methyl-6-sulfanylidene-1,2,4,5-tetrazinan-3-yl)ethanamide Openeye Name: N-(2,4-dimethoxyphenyl)-2-(3-methyl-6-thioxo-1,2,4,5-tetrazinan-3-yl)acetamide CAS Name: N-(2,4-dimethoxyphenyl)-2-(3-methyl-6-sulfanylidene-1,2,4,5-tetrazinan-3-yl)acetamide IUPAC Name: N-(2,4-dimethoxyphenyl)-2-(3-methyl-6-sulfanylidene-1,2,4,5-tetrazinan-3-yl)acetamide Traditional Name: N-(2,4-dimethoxyphenyl)-2-(3-methyl-6-thioxo-1,2,4,5-tetrazinan-3-yl)acetamide Formula: C13H19N5O3S MolecularWeight: 325.38666

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Descriptors Computed from Structure

Canonical SMILES:

CC1(NNC(=S)NN1)CC(=O)NC2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CC1(NNC(=S)NN1)CC(=O)NC2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C13H19N5O3S/c1-13(17-15-12(22)16-18-13)7-11(19)14-9-5-4-8(20-2)6-10(9)21-3/h4-6,17-18H,7H2,1-3H3,(H,14,19)(H2,15,16,22)