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

Systemtic Name: 5-(1-benzofuran-2-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6H-1,3,4-thiadiazin-2-amine Openeye Name: 5-(benzofuran-2-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6H-1,3,4-thiadiazin-2-amine CAS Name: 5-(2-benzofuranyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6H-1,3,4-thiadiazin-2-amine IUPAC Name: 5-(1-benzofuran-2-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6H-1,3,4-thiadiazin-2-amine Traditional Name: [5-(benzofuran-2-yl)-6H-1,3,4-thiadiazin-2-yl]-homoveratryl-amine Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NN=C(CS2)C3=CC4=CC=CC=C4O3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NN=C(CS2)C3=CC4=CC=CC=C4O3)OC

InChI

InChI=1S/C21H21N3O3S/c1-25-18-8-7-14(11-20(18)26-2)9-10-22-21-24-23-16(13-28-21)19-12-15-5-3-4-6-17(15)27-19/h3-8,11-12H,9-10,13H2,1-2H3,(H,22,24)