N-(1-adamantylmethyl)-5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carboxamide Openeye Name: N-(1-adamantylmethyl)-5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carboxamide CAS Name: N-(1-adamantylmethyl)-5-[(2,2-dimethyl-1-oxopropyl)amino]-3-methyl-2-thiophenecarboxamide IUPAC Name: N-(1-adamantylmethyl)-5-(2,2-dimethylpropanoylamino)-3-methylthiophene-2-carboxamide Traditional Name: N-(1-adamantylmethyl)-3-methyl-5-(pivaloylamino)thiophene-2-carboxamide Formula: C22H32N2O2S MolecularWeight: 388.56668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C(C)(C)C)C(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C(C)(C)C)C(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H32N2O2S/c1-13-5-17(24-20(26)21(2,3)4)27-18(13)19(25)23-12-22-9-14-6-15(10-22)8-16(7-14)11-22/h5,14-16H,6-12H2,1-4H3,(H,23,25)(H,24,26)