4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-(2,3,4-trimethoxybenzyl)benzamide Formula: C25H24N2O4S2 MolecularWeight: 480.59906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3)OC)OC

InChI

InChI=1S/C25H24N2O4S2/c1-29-20-13-12-18(22(30-2)23(20)31-3)14-26-24(28)17-10-8-16(9-11-17)15-32-25-27-19-6-4-5-7-21(19)33-25/h4-13H,14-15H2,1-3H3,(H,26,28)