N-[3-methyl-1-oxidanylidene-1-[2-(pyrazin-2-ylamino)ethylamino]butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-[2-(pyrazin-2-ylamino)ethylamino]butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[2-methyl-1-[2-(pyrazin-2-ylamino)ethylcarbamoyl]propyl]adamantane-1-carboxamide CAS Name: N-[3-methyl-1-oxo-1-[2-(2-pyrazinylamino)ethylamino]butan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-[2-(pyrazin-2-ylamino)ethylamino]butan-2-yl]adamantane-1-carboxamide Traditional Name: N-[2-methyl-1-[2-(pyrazin-2-ylamino)ethylcarbamoyl]propyl]adamantane-1-carboxamide Formula: C22H33N5O2 MolecularWeight: 399.52972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCNC1=NC=CN=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)C(C(=O)NCCNC1=NC=CN=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H33N5O2/c1-14(2)19(20(28)26-6-5-25-18-13-23-3-4-24-18)27-21(29)22-10-15-7-16(11-22)9-17(8-15)12-22/h3-4,13-17,19H,5-12H2,1-2H3,(H,24,25)(H,26,28)(H,27,29)