1-(4-phenoxyphenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea

Systemtic Name: 1-(4-phenoxyphenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea Openeye Name: 1-(4-phenoxyphenyl)-3-(1,1,3,3-tetramethylbutyl)thiourea CAS Name: 1-(4-phenoxyphenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea IUPAC Name: 1-(4-phenoxyphenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea Traditional Name: 1-(4-phenoxyphenyl)-3-(1,1,3,3-tetramethylbutyl)thiourea Formula: C21H28N2OS MolecularWeight: 356.52482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC(=S)NC1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)CC(C)(C)NC(=S)NC1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C21H28N2OS/c1-20(2,3)15-21(4,5)23-19(25)22-16-11-13-18(14-12-16)24-17-9-7-6-8-10-17/h6-14H,15H2,1-5H3,(H2,22,23,25)