3-(4-methylphenyl)-N-(3-propylsulfanyl-1,2,4-thiadiazol-5-yl)adamantane-1-carboxamide

Systemtic Name: 3-(4-methylphenyl)-N-(3-propylsulfanyl-1,2,4-thiadiazol-5-yl)adamantane-1-carboxamide Openeye Name: N-(3-propylsulfanyl-1,2,4-thiadiazol-5-yl)-3-(p-tolyl)adamantane-1-carboxamide CAS Name: 3-(4-methylphenyl)-N-[3-(propylthio)-1,2,4-thiadiazol-5-yl]-1-adamantanecarboxamide IUPAC Name: 3-(4-methylphenyl)-N-(3-propylsulfanyl-1,2,4-thiadiazol-5-yl)adamantane-1-carboxamide Traditional Name: N-[3-(propylthio)-1,2,4-thiadiazol-5-yl]-3-(p-tolyl)adamantane-1-carboxamide Formula: C23H29N3OS2 MolecularWeight: 427.62586

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NSC(=N1)NC(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)C

Isomeric SMILES

CCCSC1=NSC(=N1)NC(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)C

InChI

InChI=1S/C23H29N3OS2/c1-3-8-28-21-25-20(29-26-21)24-19(27)23-12-16-9-17(13-23)11-22(10-16,14-23)18-6-4-15(2)5-7-18/h4-7,16-17H,3,8-14H2,1-2H3,(H,24,25,26,27)