1-[(2-chloranyl-5-methyl-phenoxy)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide

Systemtic Name: 1-[(2-chloranyl-5-methyl-phenoxy)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide Openeye Name: 1-[(2-chloro-5-methyl-phenoxy)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide CAS Name: 1-[(2-chloro-5-methylphenoxy)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-3-pyrazolecarboxamide IUPAC Name: 1-[(2-chloro-5-methylphenoxy)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide Traditional Name: 1-[(2-chloro-5-methyl-phenoxy)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)pyrazole-3-carboxamide Formula: C20H17ClN4O2S MolecularWeight: 412.89258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OCN2C=CC(=N2)C(=O)NC3=NC4=C(S3)C=C(C=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OCN2C=CC(=N2)C(=O)NC3=NC4=C(S3)C=C(C=C4)C

InChI

InChI=1S/C20H17ClN4O2S/c1-12-3-5-14(21)17(9-12)27-11-25-8-7-16(24-25)19(26)23-20-22-15-6-4-13(2)10-18(15)28-20/h3-10H,11H2,1-2H3,(H,22,23,26)