1-(4-ethoxyphenyl)-3-[5-[(2-prop-2-enylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1-(4-ethoxyphenyl)-3-[5-[(2-prop-2-enylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-[5-[(2-allylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea CAS Name: 1-(4-ethoxyphenyl)-3-[5-[(2-prop-2-enylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(4-ethoxyphenyl)-3-[5-[(2-prop-2-enylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-[5-[(2-allylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]-3-p-phenetyl-urea Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)COC3=CC=CC=C3CC=C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)COC3=CC=CC=C3CC=C

InChI

InChI=1S/C21H22N4O3S/c1-3-7-15-8-5-6-9-18(15)28-14-19-24-25-21(29-19)23-20(26)22-16-10-12-17(13-11-16)27-4-2/h3,5-6,8-13H,1,4,7,14H2,2H3,(H2,22,23,25,26)