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

Systemtic Name: N-[1-(1-imidazol-1-ylpropan-2-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-[(2-imidazol-1-yl-1-methyl-ethyl)carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[1-[1-(1-imidazolyl)propan-2-ylamino]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-(1-imidazol-1-ylpropan-2-ylamino)-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[1-[(2-imidazol-1-yl-1-methyl-ethyl)carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C22H34N4O2 MolecularWeight: 386.53096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C)CN1C=CN=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)C(C(=O)NC(C)CN1C=CN=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H34N4O2/c1-14(2)19(20(27)24-15(3)12-26-5-4-23-13-26)25-21(28)22-9-16-6-17(10-22)8-18(7-16)11-22/h4-5,13-19H,6-12H2,1-3H3,(H,24,27)(H,25,28)