N-[1-(1-adamantylmethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide

Systemtic Name: N-[1-(1-adamantylmethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide Openeye Name: N-[1-(1-adamantylmethylcarbamoyl)-3-methylsulfanyl-propyl]-2-methoxy-benzamide CAS Name: N-[1-(1-adamantylmethylamino)-4-(methylthio)-1-oxobutan-2-yl]-2-methoxybenzamide IUPAC Name: N-[1-(1-adamantylmethylamino)-4-methylsulfanyl-1-oxobutan-2-yl]-2-methoxybenzamide Traditional Name: N-[1-(1-adamantylmethylcarbamoyl)-3-(methylthio)propyl]-2-methoxy-benzamide Formula: C24H34N2O3S MolecularWeight: 430.60336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H34N2O3S/c1-29-21-6-4-3-5-19(21)22(27)26-20(7-8-30-2)23(28)25-15-24-12-16-9-17(13-24)11-18(10-16)14-24/h3-6,16-18,20H,7-15H2,1-2H3,(H,25,28)(H,26,27)