1-(4-dodecoxyphenyl)-3-[[3-(3-phenylpropylsulfanyl)-1,2,4-thiadiazol-5-yl]amino]urea

Systemtic Name: 1-(4-dodecoxyphenyl)-3-[[3-(3-phenylpropylsulfanyl)-1,2,4-thiadiazol-5-yl]amino]urea Openeye Name: 1-(4-dodecoxyphenyl)-3-[[3-(3-phenylpropylsulfanyl)-1,2,4-thiadiazol-5-yl]amino]urea CAS Name: 1-(4-dodecoxyphenyl)-3-[[3-(3-phenylpropylthio)-1,2,4-thiadiazol-5-yl]amino]urea IUPAC Name: 1-(4-dodecoxyphenyl)-3-[[3-(3-phenylpropylsulfanyl)-1,2,4-thiadiazol-5-yl]amino]urea Traditional Name: 1-(4-lauryloxyphenyl)-3-[[3-(3-phenylpropylthio)-1,2,4-thiadiazol-5-yl]amino]urea Formula: C30H43N5O2S2 MolecularWeight: 569.82472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)NC(=O)NNC2=NC(=NS2)SCCCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)NC(=O)NNC2=NC(=NS2)SCCCC3=CC=CC=C3

InChI

InChI=1S/C30H43N5O2S2/c1-2-3-4-5-6-7-8-9-10-14-23-37-27-21-19-26(20-22-27)31-28(36)33-34-29-32-30(35-39-29)38-24-15-18-25-16-12-11-13-17-25/h11-13,16-17,19-22H,2-10,14-15,18,23-24H2,1H3,(H2,31,33,36)(H,32,34,35)