N-(3-imidazol-1-ylpropyl)-4-[(4-methylphenyl)sulfanylmethyl]benzamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-4-[(4-methylphenyl)sulfanylmethyl]benzamide Openeye Name: N-(3-imidazol-1-ylpropyl)-4-(p-tolylsulfanylmethyl)benzamide CAS Name: N-[3-(1-imidazolyl)propyl]-4-[[(4-methylphenyl)thio]methyl]benzamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-4-[(4-methylphenyl)sulfanylmethyl]benzamide Traditional Name: N-(3-imidazol-1-ylpropyl)-4-[(p-tolylthio)methyl]benzamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NCCCN3C=CN=C3

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C21H23N3OS/c1-17-3-9-20(10-4-17)26-15-18-5-7-19(8-6-18)21(25)23-11-2-13-24-14-12-22-16-24/h3-10,12,14,16H,2,11,13,15H2,1H3,(H,23,25)