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

Systemtic Name: 4-[[4-(1,3-benzothiazol-2-yl)butanoyl-cyclopropyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[4-(1,3-benzothiazol-2-yl)butanoyl-cyclopropyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[4-(1,3-benzothiazol-2-yl)-1-oxobutyl]-cyclopropylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[4-(1,3-benzothiazol-2-yl)butanoyl-cyclopropylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[4-(1,3-benzothiazol-2-yl)butanoyl-cyclopropyl-amino]methyl]-N-methyl-benzamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(C2CC2)C(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(C2CC2)C(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H25N3O2S/c1-24-23(28)17-11-9-16(10-12-17)15-26(18-13-14-18)22(27)8-4-7-21-25-19-5-2-3-6-20(19)29-21/h2-3,5-6,9-12,18H,4,7-8,13-15H2,1H3,(H,24,28)