3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCC3=C(N(N=C3C)CCC#N)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCC3=C(N(N=C3C)CCC#N)C

InChI

InChI=1S/C19H21N5OS/c1-12-6-4-7-16-18(12)22-19(26-16)21-17(25)9-8-15-13(2)23-24(14(15)3)11-5-10-20/h4,6-7H,5,8-9,11H2,1-3H3,(H,21,22,25)