N-[2-(3,4-diethoxyphenyl)ethyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-3-phenyl-2-thioxo-1H-imidazole-4-carboxamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-3-phenyl-2-thioxo-4-imidazoline-4-carboxamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CNC(=S)N2C3=CC=CC=C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CNC(=S)N2C3=CC=CC=C3)OCC

InChI

InChI=1S/C22H25N3O3S/c1-3-27-19-11-10-16(14-20(19)28-4-2)12-13-23-21(26)18-15-24-22(29)25(18)17-8-6-5-7-9-17/h5-11,14-15H,3-4,12-13H2,1-2H3,(H,23,26)(H,24,29)