N-[[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]propanethioamide

Systemtic Name: N-[[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]propanethioamide Openeye Name: N-[[4,5-bis(4-methoxyphenyl)thiazol-2-yl]methyl]propanethioamide CAS Name: N-[[4,5-bis(4-methoxyphenyl)-2-thiazolyl]methyl]propanethioamide IUPAC Name: N-[[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]propanethioamide Traditional Name: N-[[4,5-bis(4-methoxyphenyl)thiazol-2-yl]methyl]thiopropionamide Formula: C21H22N2O2S2 MolecularWeight: 398.54158

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=S)NCC1=NC(=C(S1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC(=S)NCC1=NC(=C(S1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O2S2/c1-4-18(26)22-13-19-23-20(14-5-9-16(24-2)10-6-14)21(27-19)15-7-11-17(25-3)12-8-15/h5-12H,4,13H2,1-3H3,(H,22,26)