1-tert-butyl-3-[4-[(2,5,7,8-tetramethyl-4-oxidanyl-3,4-dihydrochromen-2-yl)methoxy]phenyl]thiourea

Systemtic Name: 1-tert-butyl-3-[4-[(2,5,7,8-tetramethyl-4-oxidanyl-3,4-dihydrochromen-2-yl)methoxy]phenyl]thiourea Openeye Name: 1-tert-butyl-3-[4-[(4-hydroxy-2,5,7,8-tetramethyl-chroman-2-yl)methoxy]phenyl]thiourea CAS Name: 1-tert-butyl-3-[4-[(4-hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl)methoxy]phenyl]thiourea IUPAC Name: 1-tert-butyl-3-[4-[(4-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)methoxy]phenyl]thiourea Traditional Name: 1-tert-butyl-3-[4-[(4-hydroxy-2,5,7,8-tetramethyl-chroman-2-yl)methoxy]phenyl]thiourea Formula: C25H34N2O3S MolecularWeight: 442.61406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(CC(O2)(C)COC3=CC=C(C=C3)NC(=S)NC(C)(C)C)O)C)C

Isomeric SMILES

CC1=CC(=C(C2=C1C(CC(O2)(C)COC3=CC=C(C=C3)NC(=S)NC(C)(C)C)O)C)C

InChI

InChI=1S/C25H34N2O3S/c1-15-12-16(2)21-20(28)13-25(7,30-22(21)17(15)3)14-29-19-10-8-18(9-11-19)26-23(31)27-24(4,5)6/h8-12,20,28H,13-14H2,1-7H3,(H2,26,27,31)