N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-(1,3-dithian-2-yl)benzamide

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-(1,3-dithian-2-yl)benzamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-4-(1,3-dithian-2-yl)benzamide CAS Name: N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-4-(1,3-dithian-2-yl)benzamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-(1,3-dithian-2-yl)benzamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-4-(1,3-dithian-2-yl)benzamide Formula: C22H22N2O3S3 MolecularWeight: 458.61668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)C4SCCCS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)C4SCCCS4)OC

InChI

InChI=1S/C22H22N2O3S3/c1-26-18-9-8-16(12-19(18)27-2)17-13-30-22(23-17)24-20(25)14-4-6-15(7-5-14)21-28-10-3-11-29-21/h4-9,12-13,21H,3,10-11H2,1-2H3,(H,23,24,25)