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

Systemtic Name: 1-(4-dodecoxyphenyl)-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)amino]urea Openeye Name: 1-(4-dodecoxyphenyl)-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)amino]urea CAS Name: 1-(4-dodecoxyphenyl)-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)amino]urea IUPAC Name: 1-(4-dodecoxyphenyl)-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)amino]urea Traditional Name: 1-(4-lauryloxyphenyl)-3-[(3-phenyl-1,2,4-thiadiazol-5-yl)amino]urea Formula: C27H37N5O2S MolecularWeight: 495.67998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37N5O2S/c1-2-3-4-5-6-7-8-9-10-14-21-34-24-19-17-23(18-20-24)28-26(33)30-31-27-29-25(32-35-27)22-15-12-11-13-16-22/h11-13,15-20H,2-10,14,21H2,1H3,(H2,28,30,33)(H,29,31,32)