N-(4-methylphenyl)-4-[[5-(3-phenylpropanoylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzamide

Systemtic Name: N-(4-methylphenyl)-4-[[5-(3-phenylpropanoylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzamide Openeye Name: 4-[[5-(3-phenylpropanoylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-N-(p-tolyl)benzamide CAS Name: N-(4-methylphenyl)-4-[[[5-[(1-oxo-3-phenylpropyl)amino]-1,3,4-thiadiazol-2-yl]thio]methyl]benzamide IUPAC Name: N-(4-methylphenyl)-4-[[5-(3-phenylpropanoylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzamide Traditional Name: 4-[[[5-(hydrocinnamoylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-N-(p-tolyl)benzamide Formula: C26H24N4O2S2 MolecularWeight: 488.62436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NN=C(S3)NC(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NN=C(S3)NC(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C26H24N4O2S2/c1-18-7-14-22(15-8-18)27-24(32)21-12-9-20(10-13-21)17-33-26-30-29-25(34-26)28-23(31)16-11-19-5-3-2-4-6-19/h2-10,12-15H,11,16-17H2,1H3,(H,27,32)(H,28,29,31)