1-tert-butyl-3-[4-phenoxy-2,6-di(propan-2-yl)phenyl]thiourea

Systemtic Name: 1-tert-butyl-3-[4-phenoxy-2,6-di(propan-2-yl)phenyl]thiourea Openeye Name: 1-tert-butyl-3-(2,6-diisopropyl-4-phenoxy-phenyl)thiourea CAS Name: 1-tert-butyl-3-[4-phenoxy-2,6-di(propan-2-yl)phenyl]thiourea IUPAC Name: 1-tert-butyl-3-[4-phenoxy-2,6-di(propan-2-yl)phenyl]thiourea Traditional Name: 1-tert-butyl-3-(2,6-diisopropyl-4-phenoxy-phenyl)thiourea Formula: C46H64N4O2S2 MolecularWeight: 769.15596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=C1NC(=S)NC(C)(C)C)C(C)C)OC2=CC=CC=C2.CC(C)C1=CC(=CC(=C1NC(=S)NC(C)(C)C)C(C)C)OC2=CC=CC=C2

Isomeric SMILES

CC(C)C1=CC(=CC(=C1NC(=S)NC(C)(C)C)C(C)C)OC2=CC=CC=C2.CC(C)C1=CC(=CC(=C1NC(=S)NC(C)(C)C)C(C)C)OC2=CC=CC=C2

InChI

InChI=1S/2C23H32N2OS/c2*1-15(2)19-13-18(26-17-11-9-8-10-12-17)14-20(16(3)4)21(19)24-22(27)25-23(5,6)7/h2*8-16H,1-7H3,(H2,24,25,27)