3-(1-adamantylcarbamoylamino)-N-(2-methoxyethyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]propanamide

Systemtic Name: 3-(1-adamantylcarbamoylamino)-N-(2-methoxyethyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]propanamide Openeye Name: 3-(1-adamantylcarbamoylamino)-N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]propanamide CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]-N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]propanamide IUPAC Name: 3-(1-adamantylcarbamoylamino)-N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]propanamide Traditional Name: 3-(1-adamantylcarbamoylamino)-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-(2-methoxyethyl)propionamide Formula: C26H35N5O4 MolecularWeight: 481.5872

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H35N5O4/c1-35-9-8-31(16-22-28-21-5-3-2-4-20(21)24(33)29-22)23(32)6-7-27-25(34)30-26-13-17-10-18(14-26)12-19(11-17)15-26/h2-5,17-19H,6-16H2,1H3,(H2,27,30,34)(H,28,29,33)