5-(1,3-benzothiazol-2-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]pentanamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]pentanamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]pentanamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]pentanamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]pentanamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-(2,4,5-trimethoxybenzyl)valeramide Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)CCCCC2=NC3=CC=CC=C3S2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)CCCCC2=NC3=CC=CC=C3S2)OC)OC

InChI

InChI=1S/C22H26N2O4S/c1-26-17-13-19(28-3)18(27-2)12-15(17)14-23-21(25)10-6-7-11-22-24-16-8-4-5-9-20(16)29-22/h4-5,8-9,12-13H,6-7,10-11,14H2,1-3H3,(H,23,25)