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

Systemtic Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-butoxy-benzamide Openeye Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-butoxy-benzamide CAS Name: 3-butoxy-N-[2-(1-oxobutylamino)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-butoxybenzamide Traditional Name: 3-butoxy-N-(2-butyramido-1,3-benzothiazol-6-yl)benzamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)CCC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)CCC

InChI

InChI=1S/C22H25N3O3S/c1-3-5-12-28-17-9-6-8-15(13-17)21(27)23-16-10-11-18-19(14-16)29-22(24-18)25-20(26)7-4-2/h6,8-11,13-14H,3-5,7,12H2,1-2H3,(H,23,27)(H,24,25,26)