3-(1-adamantylcarbamoylamino)-N-[4-(prop-2-enylcarbamoylamino)phenyl]propanamide

Systemtic Name: 3-(1-adamantylcarbamoylamino)-N-[4-(prop-2-enylcarbamoylamino)phenyl]propanamide Openeye Name: 3-(1-adamantylcarbamoylamino)-N-[4-(allylcarbamoylamino)phenyl]propanamide CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]-N-[4-[[oxo-(prop-2-enylamino)methyl]amino]phenyl]propanamide IUPAC Name: 3-(1-adamantylcarbamoylamino)-N-[4-(prop-2-enylcarbamoylamino)phenyl]propanamide Traditional Name: 3-(1-adamantylcarbamoylamino)-N-[4-(allylcarbamoylamino)phenyl]propionamide Formula: C24H33N5O3 MolecularWeight: 439.55052

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H33N5O3/c1-2-8-25-22(31)28-20-5-3-19(4-6-20)27-21(30)7-9-26-23(32)29-24-13-16-10-17(14-24)12-18(11-16)15-24/h2-6,16-18H,1,7-15H2,(H,27,30)(H2,25,28,31)(H2,26,29,32)