4-[[4-(1,3-benzothiazol-2-yl)butanoyl-cyclopropyl-amino]methyl]benzamide

Systemtic Name: 4-[[4-(1,3-benzothiazol-2-yl)butanoyl-cyclopropyl-amino]methyl]benzamide Openeye Name: 4-[[4-(1,3-benzothiazol-2-yl)butanoyl-cyclopropyl-amino]methyl]benzamide CAS Name: 4-[[[4-(1,3-benzothiazol-2-yl)-1-oxobutyl]-cyclopropylamino]methyl]benzamide IUPAC Name: 4-[[4-(1,3-benzothiazol-2-yl)butanoyl-cyclopropylamino]methyl]benzamide Traditional Name: 4-[[4-(1,3-benzothiazol-2-yl)butanoyl-cyclopropyl-amino]methyl]benzamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=C(C=C2)C(=O)N)C(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC1N(CC2=CC=C(C=C2)C(=O)N)C(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H23N3O2S/c23-22(27)16-10-8-15(9-11-16)14-25(17-12-13-17)21(26)7-3-6-20-24-18-4-1-2-5-19(18)28-20/h1-2,4-5,8-11,17H,3,6-7,12-14H2,(H2,23,27)