N-[(2S)-3-methyl-1-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2S)-3-methyl-1-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1S)-2-methyl-1-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]carbamoyl]propyl]adamantane-1-carboxamide CAS Name: N-[(2S)-3-methyl-1-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2S)-3-methyl-1-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1S)-1-[(4-keto-1H-quinazolin-2-yl)methyl-methyl-carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C26H34N4O3 MolecularWeight: 450.57316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(C)CC1=NC(=O)C2=CC=CC=C2N1)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)[C@@H](C(=O)N(C)CC1=NC(=O)C2=CC=CC=C2N1)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H34N4O3/c1-15(2)22(29-25(33)26-11-16-8-17(12-26)10-18(9-16)13-26)24(32)30(3)14-21-27-20-7-5-4-6-19(20)23(31)28-21/h4-7,15-18,22H,8-14H2,1-3H3,(H,29,33)(H,27,28,31)/t16?,17?,18?,22-,26?/m0/s1