N-(1,3-benzothiazol-2-yl)-5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-5-chloro-3-methyl-1-(p-tolylmethyl)pyrazole-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-5-chloro-3-methyl-1-(4-methylbenzyl)pyrazole-4-carboxamide Formula: C20H17ClN4OS MolecularWeight: 396.89318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NC3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NC3=NC4=CC=CC=C4S3)Cl

InChI

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