5-chloranyl-3-methyl-N-(2-methyl-1,3-benzothiazol-6-yl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-(2-methyl-1,3-benzothiazol-6-yl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-3-methyl-N-(2-methyl-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-N-(2-methyl-1,3-benzothiazol-6-yl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-3-methyl-N-(2-methyl-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-3-methyl-N-(2-methyl-1,3-benzothiazol-6-yl)pyrazole-4-carboxamide Formula: C20H17ClN4OS MolecularWeight: 396.89318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)C)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)C)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C20H17ClN4OS/c1-12-18(19(21)25(24-12)11-14-6-4-3-5-7-14)20(26)23-15-8-9-16-17(10-15)27-13(2)22-16/h3-10H,11H2,1-2H3,(H,23,26)