ethyl 2-[1-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[1-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]ethanoate Openeye Name: ethyl 2-[1-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]acetate CAS Name: 2-[1-[[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]acetate Traditional Name: 2-[1-[[(4-ethoxy-3-methoxy-benzyl)-methyl-amino]methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]acetic acid ethyl ester Formula: C19H28N4O4S MolecularWeight: 408.51502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(C)CN2C(=S)N(C(=N2)CC(=O)OCC)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(C)CN2C(=S)N(C(=N2)CC(=O)OCC)C)OC

InChI

InChI=1S/C19H28N4O4S/c1-6-26-15-9-8-14(10-16(15)25-5)12-21(3)13-23-19(28)22(4)17(20-23)11-18(24)27-7-2/h8-10H,6-7,11-13H2,1-5H3