3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-1-(1,3-dioxan-2-ylmethyl)-1-pentyl-urea

Systemtic Name: 3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-1-(1,3-dioxan-2-ylmethyl)-1-pentyl-urea Openeye Name: 3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-1-(1,3-dioxan-2-ylmethyl)-1-pentyl-urea CAS Name: 3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-1-(1,3-dioxan-2-ylmethyl)-1-pentylurea IUPAC Name: 3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-1-(1,3-dioxan-2-ylmethyl)-1-pentylurea Traditional Name: 1-amyl-3-(5-butylsulfonyl-1,3,4-thiadiazol-2-yl)-1-(1,3-dioxan-2-ylmethyl)urea Formula: C17H30N4O5S2 MolecularWeight: 434.5739

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1OCCCO1)C(=O)NC2=NN=C(S2)S(=O)(=O)CCCC

Isomeric SMILES

CCCCCN(CC1OCCCO1)C(=O)NC2=NN=C(S2)S(=O)(=O)CCCC

InChI

InChI=1S/C17H30N4O5S2/c1-3-5-7-9-21(13-14-25-10-8-11-26-14)16(22)18-15-19-20-17(27-15)28(23,24)12-6-4-2/h14H,3-13H2,1-2H3,(H,18,19,22)