N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]benzamide CAS Name: N-[2-(1-oxobutylamino)-1,3-benzothiazol-6-yl]-3-phenylmethoxybenzamide IUPAC Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-(2-butyramido-1,3-benzothiazol-6-yl)benzamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H23N3O3S/c1-2-7-23(29)28-25-27-21-13-12-19(15-22(21)32-25)26-24(30)18-10-6-11-20(14-18)31-16-17-8-4-3-5-9-17/h3-6,8-15H,2,7,16H2,1H3,(H,26,30)(H,27,28,29)