2-[1-adamantylcarbamoyl(prop-2-enyl)amino]-N-(4,5-dimethyl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[1-adamantylcarbamoyl(prop-2-enyl)amino]-N-(4,5-dimethyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(allyl)amino]-N-(4,5-dimethylthiazol-2-yl)acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-prop-2-enylamino]-N-(4,5-dimethyl-2-thiazolyl)acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(prop-2-enyl)amino]-N-(4,5-dimethyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-[1-adamantylcarbamoyl(allyl)amino]-N-(4,5-dimethylthiazol-2-yl)acetamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CN(CC=C)C(=O)NC23CC4CC(C2)CC(C4)C3)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CN(CC=C)C(=O)NC23CC4CC(C2)CC(C4)C3)C

InChI

InChI=1S/C21H30N4O2S/c1-4-5-25(12-18(26)23-19-22-13(2)14(3)28-19)20(27)24-21-9-15-6-16(10-21)8-17(7-15)11-21/h4,15-17H,1,5-12H2,2-3H3,(H,24,27)(H,22,23,26)