methyl 4-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]benzenecarboximidothioate

Systemtic Name: methyl 4-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]benzenecarboximidothioate Openeye Name: methyl 4-[2-(3,4-diethoxyphenyl)thiazol-4-yl]benzenecarboximidothioate CAS Name: 4-[2-(3,4-diethoxyphenyl)-4-thiazolyl]benzenecarboximidothioic acid methyl ester IUPAC Name: methyl 4-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]benzenecarboximidothioate Traditional Name: 4-[2-(3,4-diethoxyphenyl)thiazol-4-yl]benzenecarboximidothioic acid methyl ester Formula: C21H22N2O2S2 MolecularWeight: 398.54158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC=C(C=C3)C(=N)SC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC=C(C=C3)C(=N)SC)OCC

InChI

InChI=1S/C21H22N2O2S2/c1-4-24-18-11-10-16(12-19(18)25-5-2)21-23-17(13-27-21)14-6-8-15(9-7-14)20(22)26-3/h6-13,22H,4-5H2,1-3H3