3-[(4-aminophenyl)methyl]-5-methoxy-6H-1,3,4-thiadiazin-2-one; 5-oxabicyclo[2.1.1]hexane

Systemtic Name: 3-[(4-aminophenyl)methyl]-5-methoxy-6H-1,3,4-thiadiazin-2-one; 5-oxabicyclo[2.1.1]hexane Openeye Name: 3-[(4-aminophenyl)methyl]-5-methoxy-6H-1,3,4-thiadiazin-2-one; 5-oxabicyclo[2.1.1]hexane CAS Name: 3-[(4-aminophenyl)methyl]-5-methoxy-6H-1,3,4-thiadiazin-2-one; 5-oxabicyclo[2.1.1]hexane IUPAC Name: 3-[(4-aminophenyl)methyl]-5-methoxy-6H-1,3,4-thiadiazin-2-one; 5-oxabicyclo[2.1.1]hexane Traditional Name: 3-(4-aminobenzyl)-5-methoxy-6H-1,3,4-thiadiazin-2-one; 5-oxabicyclo[2.1.1]hexane Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C(=O)SC1)CC2=CC=C(C=C2)N.C1CC2CC1O2

Isomeric SMILES

COC1=NN(C(=O)SC1)CC2=CC=C(C=C2)N.C1CC2CC1O2

InChI

InChI=1S/C11H13N3O2S.C5H8O/c1-16-10-7-17-11(15)14(13-10)6-8-2-4-9(12)5-3-8;1-2-5-3-4(1)6-5/h2-5H,6-7,12H2,1H3;4-5H,1-3H2