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

Systemtic Name: N-[2-(4-chloranyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2,4-dimethyl-benzamide Openeye Name: N-[2-(4-chloro-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2,4-dimethyl-benzamide CAS Name: N-[2-(4-chloro-1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]-2,4-dimethylbenzamide IUPAC Name: N-[2-(4-chloro-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]-2,4-dimethylbenzamide Traditional Name: N-[2-(4-chloro-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2,4-dimethyl-benzamide Formula: C20H17ClN4OS MolecularWeight: 396.89318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC2=CC(=NN2C3=NC4=C(S3)C=CC=C4Cl)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC2=CC(=NN2C3=NC4=C(S3)C=CC=C4Cl)C)C

InChI

InChI=1S/C20H17ClN4OS/c1-11-7-8-14(12(2)9-11)19(26)22-17-10-13(3)24-25(17)20-23-18-15(21)5-4-6-16(18)27-20/h4-10H,1-3H3,(H,22,26)