5-chloranyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Openeye Name: 5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-1-(p-tolylmethyl)pyrazole-4-carboxamide CAS Name: 5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Traditional Name: 5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-1-(4-methylbenzyl)pyrazole-4-carboxamide Formula: C21H19ClN4O2S MolecularWeight: 426.91916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NC3=NC4=C(S3)C=C(C=C4)OC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NC3=NC4=C(S3)C=C(C=C4)OC)Cl

InChI

InChI=1S/C21H19ClN4O2S/c1-12-4-6-14(7-5-12)11-26-19(22)18(13(2)25-26)20(27)24-21-23-16-9-8-15(28-3)10-17(16)29-21/h4-10H,11H2,1-3H3,(H,23,24,27)