N-[[4-(2-methylpropanoylamino)phenyl]methyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[[4-(2-methylpropanoylamino)phenyl]methyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-[[4-(2-methylpropanoylamino)phenyl]methyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[[4-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[[4-(2-methylpropanoylamino)phenyl]methyl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-[4-(isobutyrylamino)benzyl]-1,3-benzothiazole-6-carboxamide Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C19H19N3O2S/c1-12(2)18(23)22-15-6-3-13(4-7-15)10-20-19(24)14-5-8-16-17(9-14)25-11-21-16/h3-9,11-12H,10H2,1-2H3,(H,20,24)(H,22,23)