N-(4-bromanyl-2-methyl-phenyl)-3-(2-oxidanylidene-1,3-benzothiazol-3-yl)propanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-3-(2-oxidanylidene-1,3-benzothiazol-3-yl)propanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide CAS Name: N-(4-bromo-2-methylphenyl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide IUPAC Name: N-(4-bromo-2-methylphenyl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-3-(2-keto-1,3-benzothiazol-3-yl)propionamide Formula: C17H15BrN2O2S MolecularWeight: 391.2822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CCN2C3=CC=CC=C3SC2=O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CCN2C3=CC=CC=C3SC2=O

InChI

InChI=1S/C17H15BrN2O2S/c1-11-10-12(18)6-7-13(11)19-16(21)8-9-20-14-4-2-3-5-15(14)23-17(20)22/h2-7,10H,8-9H2,1H3,(H,19,21)