N-[(2S)-1-[2-(4-ethylphenyl)carbonylhydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2S)-1-[2-(4-ethylphenyl)carbonylhydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1S)-1-[[(4-ethylbenzoyl)amino]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[(2S)-1-[[(4-ethylphenyl)-oxomethyl]hydrazo]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2S)-1-[2-(4-ethylbenzoyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1S)-1-[[(4-ethylbenzoyl)amino]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C25H35N3O3 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NNC(=O)C(C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NNC(=O)[C@H](C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C25H35N3O3/c1-4-16-5-7-20(8-6-16)22(29)27-28-23(30)21(15(2)3)26-24(31)25-12-17-9-18(13-25)11-19(10-17)14-25/h5-8,15,17-19,21H,4,9-14H2,1-3H3,(H,26,31)(H,27,29)(H,28,30)/t17?,18?,19?,21-,25?/m0/s1