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

Systemtic Name: N-(2-dimethylaminoethyl)-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-N-[2-[(4-methylthiazol-2-yl)amino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-(2-dimethylaminoethyl)-N-[2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-N-[2-keto-2-[(4-methylthiazol-2-yl)amino]ethyl]adamantane-1-carboxamide Formula: C21H32N4O2S MolecularWeight: 404.56938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CN(CCN(C)C)C(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CN(CCN(C)C)C(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H32N4O2S/c1-14-13-28-20(22-14)23-18(26)12-25(5-4-24(2)3)19(27)21-9-15-6-16(10-21)8-17(7-15)11-21/h13,15-17H,4-12H2,1-3H3,(H,22,23,26)