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

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-[(3,4-dimethoxyphenyl)methyl]pentanamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-[(3,4-dimethoxyphenyl)methyl]pentanamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-[(3,4-dimethoxyphenyl)methyl]pentanamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-[(3,4-dimethoxyphenyl)methyl]pentanamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-veratryl-valeramide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CCCCC2=NC3=CC=CC=C3S2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CCCCC2=NC3=CC=CC=C3S2)OC

InChI

InChI=1S/C21H24N2O3S/c1-25-17-12-11-15(13-18(17)26-2)14-22-20(24)9-5-6-10-21-23-16-7-3-4-8-19(16)27-21/h3-4,7-8,11-13H,5-6,9-10,14H2,1-2H3,(H,22,24)