1,3-bis(4-methyl-7-oxidanyl-4-phenyl-heptyl)thiourea

Systemtic Name: 1,3-bis(4-methyl-7-oxidanyl-4-phenyl-heptyl)thiourea Openeye Name: 1,3-bis(7-hydroxy-4-methyl-4-phenyl-heptyl)thiourea CAS Name: 1,3-bis(7-hydroxy-4-methyl-4-phenylheptyl)thiourea IUPAC Name: 1,3-bis(7-hydroxy-4-methyl-4-phenylheptyl)thiourea Traditional Name: 1,3-bis(7-hydroxy-4-methyl-4-phenyl-heptyl)thiourea Formula: C29H44N2O2S MolecularWeight: 484.73686

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCNC(=S)NCCCC(C)(CCCO)C1=CC=CC=C1)(CCCO)C2=CC=CC=C2

Isomeric SMILES

CC(CCCNC(=S)NCCCC(C)(CCCO)C1=CC=CC=C1)(CCCO)C2=CC=CC=C2

InChI

InChI=1S/C29H44N2O2S/c1-28(19-11-23-32,25-13-5-3-6-14-25)17-9-21-30-27(34)31-22-10-18-29(2,20-12-24-33)26-15-7-4-8-16-26/h3-8,13-16,32-33H,9-12,17-24H2,1-2H3,(H2,30,31,34)