N-butyl-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-butyl-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-butyl-N-[2-[(4-methylthiazol-2-yl)amino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-butyl-N-[2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-butyl-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-butyl-N-[2-keto-2-[(4-methylthiazol-2-yl)amino]ethyl]adamantane-1-carboxamide Formula: C21H31N3O2S MolecularWeight: 389.55474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=NC(=CS1)C)C(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCCN(CC(=O)NC1=NC(=CS1)C)C(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H31N3O2S/c1-3-4-5-24(12-18(25)23-20-22-14(2)13-27-20)19(26)21-9-15-6-16(10-21)8-17(7-15)11-21/h13,15-17H,3-12H2,1-2H3,(H,22,23,25)