3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-[(4,7-dihexyl-1,3-dioxepan-2-yl)methyl]-1-methyl-urea

Systemtic Name: 3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-[(4,7-dihexyl-1,3-dioxepan-2-yl)methyl]-1-methyl-urea Openeye Name: 3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-[(4,7-dihexyl-1,3-dioxepan-2-yl)methyl]-1-methyl-urea CAS Name: 3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-[(4,7-dihexyl-1,3-dioxepan-2-yl)methyl]-1-methylurea IUPAC Name: 3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-[(4,7-dihexyl-1,3-dioxepan-2-yl)methyl]-1-methylurea Traditional Name: 3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-[(4,7-dihexyl-1,3-dioxepan-2-yl)methyl]-1-methyl-urea Formula: C26H48N4O3S MolecularWeight: 496.74932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(OC(O1)CN(C)C(=O)NC2=NN=C(S2)C(C)(C)C)CCCCCC

Isomeric SMILES

CCCCCCC1CCC(OC(O1)CN(C)C(=O)NC2=NN=C(S2)C(C)(C)C)CCCCCC

InChI

InChI=1S/C26H48N4O3S/c1-7-9-11-13-15-20-17-18-21(16-14-12-10-8-2)33-22(32-20)19-30(6)25(31)27-24-29-28-23(34-24)26(3,4)5/h20-22H,7-19H2,1-6H3,(H,27,29,31)