2-(1,3-benzothiazol-2-ylsulfanyl)-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(1-benzylpyrazol-4-yl)methyl]-N-methylacetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-acetamide Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N4OS2/c1-24(12-17-11-22-25(14-17)13-16-7-3-2-4-8-16)20(26)15-27-21-23-18-9-5-6-10-19(18)28-21/h2-11,14H,12-13,15H2,1H3