N-[3-oxidanylidene-3-[[4-(prop-2-enylcarbamoylamino)phenyl]amino]propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-oxidanylidene-3-[[4-(prop-2-enylcarbamoylamino)phenyl]amino]propyl]adamantane-1-carboxamide Openeye Name: N-[3-[4-(allylcarbamoylamino)anilino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-oxo-3-[4-[[oxo-(prop-2-enylamino)methyl]amino]anilino]propyl]-1-adamantanecarboxamide IUPAC Name: N-[3-oxo-3-[4-(prop-2-enylcarbamoylamino)anilino]propyl]adamantane-1-carboxamide Traditional Name: N-[3-[4-(allylcarbamoylamino)anilino]-3-keto-propyl]adamantane-1-carboxamide Formula: C24H32N4O3 MolecularWeight: 424.53588

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H32N4O3/c1-2-8-26-23(31)28-20-5-3-19(4-6-20)27-21(29)7-9-25-22(30)24-13-16-10-17(14-24)12-18(11-16)15-24/h2-6,16-18H,1,7-15H2,(H,25,30)(H,27,29)(H2,26,28,31)