N-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethyl-pyrazol-4-yl]-3-methyl-butanamide

Systemtic Name: N-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethyl-pyrazol-4-yl]-3-methyl-butanamide Openeye Name: N-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-ethyl-pyrazol-4-yl]-3-methyl-butanamide CAS Name: N-[1-[4-(4-bromophenyl)-2-thiazolyl]-5-ethyl-4-pyrazolyl]-3-methylbutanamide IUPAC Name: N-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethylpyrazol-4-yl]-3-methylbutanamide Traditional Name: N-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-ethyl-pyrazol-4-yl]-3-methyl-butyramide Formula: C19H21BrN4OS MolecularWeight: 433.36524

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=NC(=CS2)C3=CC=C(C=C3)Br)NC(=O)CC(C)C

Isomeric SMILES

CCC1=C(C=NN1C2=NC(=CS2)C3=CC=C(C=C3)Br)NC(=O)CC(C)C

InChI

InChI=1S/C19H21BrN4OS/c1-4-17-15(22-18(25)9-12(2)3)10-21-24(17)19-23-16(11-26-19)13-5-7-14(20)8-6-13/h5-8,10-12H,4,9H2,1-3H3,(H,22,25)