1-[[2-oxidanyl-3,5-di(propan-2-yl)phenyl]carbonylamino]-3-phenethyl-thiourea

Systemtic Name: 1-[[2-oxidanyl-3,5-di(propan-2-yl)phenyl]carbonylamino]-3-phenethyl-thiourea Openeye Name: 1-[(2-hydroxy-3,5-diisopropyl-benzoyl)amino]-3-phenethyl-thiourea CAS Name: 1-[[[2-hydroxy-3,5-di(propan-2-yl)phenyl]-oxomethyl]amino]-3-phenethylthiourea IUPAC Name: 1-[[2-hydroxy-3,5-di(propan-2-yl)benzoyl]amino]-3-phenethylthiourea Traditional Name: 1-[(2-hydroxy-3,5-diisopropyl-benzoyl)amino]-3-phenethyl-thiourea Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(=O)NNC(=S)NCCC2=CC=CC=C2)O)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(=O)NNC(=S)NCCC2=CC=CC=C2)O)C(C)C

InChI

InChI=1S/C22H29N3O2S/c1-14(2)17-12-18(15(3)4)20(26)19(13-17)21(27)24-25-22(28)23-11-10-16-8-6-5-7-9-16/h5-9,12-15,26H,10-11H2,1-4H3,(H,24,27)(H2,23,25,28)