N-[(2S)-1-[2-(5-ethyl-4-methyl-thiophen-2-yl)carbonylhydrazinyl]-1-oxidanylidene-propan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2S)-1-[2-(5-ethyl-4-methyl-thiophen-2-yl)carbonylhydrazinyl]-1-oxidanylidene-propan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1S)-2-[2-(5-ethyl-4-methyl-thiophene-2-carbonyl)hydrazino]-1-methyl-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[(2S)-1-[[(5-ethyl-4-methyl-2-thiophenyl)-oxomethyl]hydrazo]-1-oxopropan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2S)-1-[2-(5-ethyl-4-methylthiophene-2-carbonyl)hydrazinyl]-1-oxopropan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1S)-2-[N'-(5-ethyl-4-methyl-thiophene-2-carbonyl)hydrazino]-2-keto-1-methyl-ethyl]adamantane-1-carboxamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C(=O)NNC(=O)C(C)NC(=O)C23CC4CC(C2)CC(C4)C3)C

Isomeric SMILES

CCC1=C(C=C(S1)C(=O)NNC(=O)[C@H](C)NC(=O)C23CC4CC(C2)CC(C4)C3)C

InChI

InChI=1S/C22H31N3O3S/c1-4-17-12(2)5-18(29-17)20(27)25-24-19(26)13(3)23-21(28)22-9-14-6-15(10-22)8-16(7-14)11-22/h5,13-16H,4,6-11H2,1-3H3,(H,23,28)(H,24,26)(H,25,27)/t13-,14?,15?,16?,22?/m0/s1