4-(1,3-dithiolan-2-yl)-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]benzamide

Systemtic Name: 4-(1,3-dithiolan-2-yl)-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]benzamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-4-(1,3-dithiolan-2-yl)-N-methyl-benzamide CAS Name: 4-(1,3-dithiolan-2-yl)-N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]benzamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-4-(1,3-dithiolan-2-yl)-N-methylbenzamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-4-(1,3-dithiolan-2-yl)-N-methyl-benzamide Formula: C22H23N3OS2 MolecularWeight: 409.56752

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C22H23N3OS2/c1-24(14-18-13-23-25(16-18)15-17-5-3-2-4-6-17)21(26)19-7-9-20(10-8-19)22-27-11-12-28-22/h2-10,13,16,22H,11-12,14-15H2,1H3