N-cyclopentyl-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6H-1,3,4-thiadiazin-2-amine

Systemtic Name: N-cyclopentyl-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6H-1,3,4-thiadiazin-2-amine Openeye Name: N-cyclopentyl-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6H-1,3,4-thiadiazin-2-amine CAS Name: N-cyclopentyl-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6H-1,3,4-thiadiazin-2-amine IUPAC Name: N-cyclopentyl-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6H-1,3,4-thiadiazin-2-amine Traditional Name: cyclopentyl-[5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6H-1,3,4-thiadiazin-2-yl]amine Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NN=C(CS2)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CCC(C1)NC2=NN=C(CS2)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C17H21N3O2S/c1-2-5-13(4-1)18-17-20-19-14(11-23-17)12-6-7-15-16(10-12)22-9-3-8-21-15/h6-7,10,13H,1-5,8-9,11H2,(H,18,20)