5-(1-adamantyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6H-1,3,4-thiadiazin-2-amine

Systemtic Name: 5-(1-adamantyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6H-1,3,4-thiadiazin-2-amine Openeye Name: 5-(1-adamantyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6H-1,3,4-thiadiazin-2-amine CAS Name: 5-(1-adamantyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6H-1,3,4-thiadiazin-2-amine IUPAC Name: 5-(1-adamantyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6H-1,3,4-thiadiazin-2-amine Traditional Name: [5-(1-adamantyl)-6H-1,3,4-thiadiazin-2-yl]-homoveratryl-amine Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NN=C(CS2)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NN=C(CS2)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C23H31N3O2S/c1-27-19-4-3-15(10-20(19)28-2)5-6-24-22-26-25-21(14-29-22)23-11-16-7-17(12-23)9-18(8-16)13-23/h3-4,10,16-18H,5-9,11-14H2,1-2H3,(H,24,26)