5-[2-(1-adamantyl)ethanoylamino]-4-cyano-N,N-diethyl-3-methyl-thiophene-2-carboxamide

Systemtic Name: 5-[2-(1-adamantyl)ethanoylamino]-4-cyano-N,N-diethyl-3-methyl-thiophene-2-carboxamide Openeye Name: 5-[[2-(1-adamantyl)acetyl]amino]-4-cyano-N,N-diethyl-3-methyl-thiophene-2-carboxamide CAS Name: 5-[[2-(1-adamantyl)-1-oxoethyl]amino]-4-cyano-N,N-diethyl-3-methyl-2-thiophenecarboxamide IUPAC Name: 5-[[2-(1-adamantyl)acetyl]amino]-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide Traditional Name: 5-[[2-(1-adamantyl)acetyl]amino]-4-cyano-N,N-diethyl-3-methyl-thiophene-2-carboxamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CC23CC4CC(C2)CC(C4)C3)C#N)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CC23CC4CC(C2)CC(C4)C3)C#N)C

InChI

InChI=1S/C23H31N3O2S/c1-4-26(5-2)22(28)20-14(3)18(13-24)21(29-20)25-19(27)12-23-9-15-6-16(10-23)8-17(7-15)11-23/h15-17H,4-12H2,1-3H3,(H,25,27)