N-(1-adamantylmethyl)-2-(4-methoxyphenyl)sulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-2-(4-methoxyphenyl)sulfanyl-pyridine-3-carboxamide Openeye Name: N-(1-adamantylmethyl)-2-(4-methoxyphenyl)sulfanyl-pyridine-3-carboxamide CAS Name: N-(1-adamantylmethyl)-2-[(4-methoxyphenyl)thio]-3-pyridinecarboxamide IUPAC Name: N-(1-adamantylmethyl)-2-(4-methoxyphenyl)sulfanylpyridine-3-carboxamide Traditional Name: N-(1-adamantylmethyl)-2-[(4-methoxyphenyl)thio]nicotinamide Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H28N2O2S/c1-28-19-4-6-20(7-5-19)29-23-21(3-2-8-25-23)22(27)26-15-24-12-16-9-17(13-24)11-18(10-16)14-24/h2-8,16-18H,9-15H2,1H3,(H,26,27)