N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-1-benzyl-N-methyl-pyrazole-4-carboxamide CAS Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-1-benzyl-N-methylpyrazole-4-carboxamide Traditional Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-1-benzyl-N-methyl-pyrazole-4-carboxamide Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H20N4OS/c1-15(20-23-18-10-6-7-11-19(18)27-20)24(2)21(26)17-12-22-25(14-17)13-16-8-4-3-5-9-16/h3-12,14-15H,13H2,1-2H3