N-[(2R)-3-methyl-1-oxidanylidene-1-(2-thiophen-2-ylcarbonylhydrazinyl)butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2R)-3-methyl-1-oxidanylidene-1-(2-thiophen-2-ylcarbonylhydrazinyl)butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1R)-2-methyl-1-[(thiophene-2-carbonylamino)carbamoyl]propyl]adamantane-1-carboxamide CAS Name: N-[(2R)-3-methyl-1-oxo-1-[[oxo(thiophen-2-yl)methyl]hydrazo]butan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2R)-3-methyl-1-oxo-1-[2-(thiophene-2-carbonyl)hydrazinyl]butan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1R)-2-methyl-1-[(2-thenoylamino)carbamoyl]propyl]adamantane-1-carboxamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NNC(=O)C1=CC=CS1)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)[C@H](C(=O)NNC(=O)C1=CC=CS1)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H29N3O3S/c1-12(2)17(19(26)24-23-18(25)16-4-3-5-28-16)22-20(27)21-9-13-6-14(10-21)8-15(7-13)11-21/h3-5,12-15,17H,6-11H2,1-2H3,(H,22,27)(H,23,25)(H,24,26)/t13?,14?,15?,17-,21?/m1/s1