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4-[(1-adamantylcarbonylamino)carbamoyl]-N-prop-2-enyl-benzenesulfonamide

4-[(1-adamantylcarbonylamino)carbamoyl]-N-prop-2-enyl-benzenesulfonamide

Systemtic Name:4-[(1-adamantylcarbonylamino)carbamoyl]-N-prop-2-enyl-benzenesulfonamide
Openeye Name:4-[(adamantane-1-carbonylamino)carbamoyl]-N-allyl-benzenesulfonamide
CAS Name:4-[[[1-adamantyl(oxo)methyl]hydrazo]-oxomethyl]-N-prop-2-enylbenzenesulfonamide
IUPAC Name:4-[(adamantane-1-carbonylamino)carbamoyl]-N-prop-2-enylbenzenesulfonamide
Traditional Name:4-[(adamantane-1-carbonylamino)carbamoyl]-N-allyl-benzenesulfonamide
Formula: C21H27N3O4S
MolecularWeight: 417.52178
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Descriptors Computed from Structure

Canonical SMILES:

C=CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C23CC4CC(C2)CC(C4)C3


Isomeric SMILES

C=CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C23CC4CC(C2)CC(C4)C3


InChI

InChI=1S/C21H27N3O4S/c1-2-7-22-29(27,28)18-5-3-17(4-6-18)19(25)23-24-20(26)21-11-14-8-15(12-21)10-16(9-14)13-21/h2-6,14-16,22H,1,7-13H2,(H,23,25)(H,24,26)


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