3-[2-(1-adamantylsulfanyl)ethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 3-[2-(1-adamantylsulfanyl)ethanoylamino]-N,N-diethyl-benzamide Openeye Name: 3-[[2-(1-adamantylsulfanyl)acetyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[2-(1-adamantylthio)-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[2-(1-adamantylsulfanyl)acetyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[2-(1-adamantylthio)acetyl]amino]-N,N-diethyl-benzamide Formula: C23H32N2O2S MolecularWeight: 400.57738

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CSC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CSC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H32N2O2S/c1-3-25(4-2)22(27)19-6-5-7-20(11-19)24-21(26)15-28-23-12-16-8-17(13-23)10-18(9-16)14-23/h5-7,11,16-18H,3-4,8-10,12-15H2,1-2H3,(H,24,26)