1-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-[(4-hexyl-1,3-dioxepan-2-yl)methyl]-3-methyl-1-pentyl-urea

Systemtic Name: 1-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-[(4-hexyl-1,3-dioxepan-2-yl)methyl]-3-methyl-1-pentyl-urea Openeye Name: 1-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-[(4-hexyl-1,3-dioxepan-2-yl)methyl]-3-methyl-1-pentyl-urea CAS Name: 1-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-[(4-hexyl-1,3-dioxepan-2-yl)methyl]-3-methyl-1-pentylurea IUPAC Name: 1-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-[(4-hexyl-1,3-dioxepan-2-yl)methyl]-3-methyl-1-pentylurea Traditional Name: 1-amyl-1-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-[(4-hexyl-1,3-dioxepan-2-yl)methyl]-3-methyl-urea Formula: C25H46N4O3S MolecularWeight: 482.72274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCCOC(O1)CN(C)C(=O)N(CCCCC)C2=NN=C(S2)C(C)(C)C

Isomeric SMILES

CCCCCCC1CCCOC(O1)CN(C)C(=O)N(CCCCC)C2=NN=C(S2)C(C)(C)C

InChI

InChI=1S/C25H46N4O3S/c1-7-9-11-12-15-20-16-14-18-31-21(32-20)19-28(6)24(30)29(17-13-10-8-2)23-27-26-22(33-23)25(3,4)5/h20-21H,7-19H2,1-6H3