N'-[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]adamantane-1-carbohydrazide

Systemtic Name: N'-[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]adamantane-1-carbohydrazide Openeye Name: N'-[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]adamantane-1-carbohydrazide CAS Name: N'-[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-1-adamantanecarbohydrazide IUPAC Name: N'-[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]adamantane-1-carbohydrazide Traditional Name: N'-[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]acetyl]adamantane-1-carbohydrazide Formula: C27H29N5O2S MolecularWeight: 487.61646

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NNC(=O)CSC4=NN=C(N4C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NNC(=O)CSC4=NN=C(N4C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C27H29N5O2S/c33-23(28-30-25(34)27-14-18-11-19(15-27)13-20(12-18)16-27)17-35-26-31-29-24(21-7-3-1-4-8-21)32(26)22-9-5-2-6-10-22/h1-10,18-20H,11-17H2,(H,28,33)(H,30,34)