4-(1,3-dithian-2-yl)-N-[2-(4-methylpentan-2-yl)pyrazol-3-yl]benzamide

Systemtic Name: 4-(1,3-dithian-2-yl)-N-[2-(4-methylpentan-2-yl)pyrazol-3-yl]benzamide Openeye Name: N-[2-(1,3-dimethylbutyl)pyrazol-3-yl]-4-(1,3-dithian-2-yl)benzamide CAS Name: 4-(1,3-dithian-2-yl)-N-[2-(4-methylpentan-2-yl)-3-pyrazolyl]benzamide IUPAC Name: 4-(1,3-dithian-2-yl)-N-[2-(4-methylpentan-2-yl)pyrazol-3-yl]benzamide Traditional Name: N-[2-(1,3-dimethylbutyl)pyrazol-3-yl]-4-(1,3-dithian-2-yl)benzamide Formula: C20H27N3OS2 MolecularWeight: 389.57788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)N1C(=CC=N1)NC(=O)C2=CC=C(C=C2)C3SCCCS3

Isomeric SMILES

CC(C)CC(C)N1C(=CC=N1)NC(=O)C2=CC=C(C=C2)C3SCCCS3

InChI

InChI=1S/C20H27N3OS2/c1-14(2)13-15(3)23-18(9-10-21-23)22-19(24)16-5-7-17(8-6-16)20-25-11-4-12-26-20/h5-10,14-15,20H,4,11-13H2,1-3H3,(H,22,24)