N-[4-(1-adamantylcarbonylamino)-2,5-diethoxy-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-(1-adamantylcarbonylamino)-2,5-diethoxy-phenyl]thiophene-2-carboxamide Openeye Name: N-[4-(adamantane-1-carbonylamino)-2,5-diethoxy-phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[1-adamantyl(oxo)methyl]amino]-2,5-diethoxyphenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-(adamantane-1-carbonylamino)-2,5-diethoxyphenyl]thiophene-2-carboxamide Traditional Name: N-[4-(adamantane-1-carbonylamino)-2,5-diethoxy-phenyl]thiophene-2-carboxamide Formula: C26H32N2O4S MolecularWeight: 468.60828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CS2)OCC)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CS2)OCC)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H32N2O4S/c1-3-31-21-12-20(22(32-4-2)11-19(21)27-24(29)23-6-5-7-33-23)28-25(30)26-13-16-8-17(14-26)10-18(9-16)15-26/h5-7,11-12,16-18H,3-4,8-10,13-15H2,1-2H3,(H,27,29)(H,28,30)