1-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoylamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoylamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoylamino]thiourea CAS Name: 1-[[3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxopropyl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoylamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoylamino]thiourea Formula: C21H33N3O2S MolecularWeight: 391.57062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)NNC(=S)NCC=C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)NNC(=S)NCC=C

InChI

InChI=1S/C21H33N3O2S/c1-8-11-22-19(27)24-23-17(25)10-9-14-12-15(20(2,3)4)18(26)16(13-14)21(5,6)7/h8,12-13,26H,1,9-11H2,2-7H3,(H,23,25)(H2,22,24,27)