N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(1-phenylpyrazol-4-yl)ethanamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(1-phenylpyrazol-4-yl)ethanamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(1-phenylpyrazol-4-yl)acetamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(1-phenyl-4-pyrazolyl)acetamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(1-phenylpyrazol-4-yl)acetamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(1-phenylpyrazol-4-yl)acetamide Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CC3=CN(N=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CC3=CN(N=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C20H18N4OS/c1-13-8-14(2)19-17(9-13)26-20(23-19)22-18(25)10-15-11-21-24(12-15)16-6-4-3-5-7-16/h3-9,11-12H,10H2,1-2H3,(H,22,23,25)