N3-(2-adamantylmethyl)-1-[(5-methylfuran-2-yl)methyl]-4-oxidanylidene-N5-prop-2-enyl-pyridine-3,5-dicarboxamide

Systemtic Name: N3-(2-adamantylmethyl)-1-[(5-methylfuran-2-yl)methyl]-4-oxidanylidene-N5-prop-2-enyl-pyridine-3,5-dicarboxamide Openeye Name: N3-(2-adamantylmethyl)-N5-allyl-1-[(5-methyl-2-furyl)methyl]-4-oxo-pyridine-3,5-dicarboxamide CAS Name: N3-(2-adamantylmethyl)-1-[(5-methyl-2-furanyl)methyl]-4-oxo-N5-prop-2-enylpyridine-3,5-dicarboxamide IUPAC Name: 3-N-(2-adamantylmethyl)-1-[(5-methylfuran-2-yl)methyl]-4-oxo-5-N-prop-2-enylpyridine-3,5-dicarboxamide Traditional Name: N-(2-adamantylmethyl)-N'-allyl-4-keto-1-[(5-methyl-2-furyl)methyl]dinicotinamide Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN2C=C(C(=O)C(=C2)C(=O)NCC3C4CC5CC(C4)CC3C5)C(=O)NCC=C

Isomeric SMILES

CC1=CC=C(O1)CN2C=C(C(=O)C(=C2)C(=O)NCC3C4CC5CC(C4)CC3C5)C(=O)NCC=C

InChI

InChI=1S/C27H33N3O4/c1-3-6-28-26(32)23-14-30(13-21-5-4-16(2)34-21)15-24(25(23)31)27(33)29-12-22-19-8-17-7-18(10-19)11-20(22)9-17/h3-5,14-15,17-20,22H,1,6-13H2,2H3,(H,28,32)(H,29,33)