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

Systemtic Name: 4-(1,3-dithiolan-2-yl)-N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]benzamide Openeye Name: 4-(1,3-dithiolan-2-yl)-N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]benzamide CAS Name: 4-(1,3-dithiolan-2-yl)-N-[3-(3-methyl-1-phenyl-4-pyrazolyl)propyl]benzamide IUPAC Name: 4-(1,3-dithiolan-2-yl)-N-[3-(3-methyl-1-phenylpyrazol-4-yl)propyl]benzamide Traditional Name: 4-(1,3-dithiolan-2-yl)-N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]benzamide Formula: C23H25N3OS2 MolecularWeight: 423.5941

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CCCNC(=O)C2=CC=C(C=C2)C3SCCS3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C=C1CCCNC(=O)C2=CC=C(C=C2)C3SCCS3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS2/c1-17-20(16-26(25-17)21-7-3-2-4-8-21)6-5-13-24-22(27)18-9-11-19(12-10-18)23-28-14-15-29-23/h2-4,7-12,16,23H,5-6,13-15H2,1H3,(H,24,27)