3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C16H17BrN4OS MolecularWeight: 393.30138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C(=C(C(=N3)C)Br)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C(=C(C(=N3)C)Br)C

InChI

InChI=1S/C16H17BrN4OS/c1-9-4-5-12-13(8-9)23-16(18-12)19-14(22)6-7-21-11(3)15(17)10(2)20-21/h4-5,8H,6-7H2,1-3H3,(H,18,19,22)