N-(1,3-benzothiazol-2-ylmethyl)-5-chloranyl-N,3-dimethyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-5-chloranyl-N,3-dimethyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-benzyl-5-chloro-N,3-dimethyl-pyrazole-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-5-chloro-N,3-dimethyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-benzyl-5-chloro-N,3-dimethylpyrazole-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-1-benzyl-5-chloro-N,3-dimethyl-pyrazole-4-carboxamide Formula: C21H19ClN4OS MolecularWeight: 410.91976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N(C)CC2=NC3=CC=CC=C3S2)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)N(C)CC2=NC3=CC=CC=C3S2)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C21H19ClN4OS/c1-14-19(20(22)26(24-14)12-15-8-4-3-5-9-15)21(27)25(2)13-18-23-16-10-6-7-11-17(16)28-18/h3-11H,12-13H2,1-2H3