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

Systemtic Name: 1-(3-nitrophenyl)-3-[[2-oxidanyl-3,5-di(propan-2-yl)phenyl]carbonylamino]thiourea Openeye Name: 1-[(2-hydroxy-3,5-diisopropyl-benzoyl)amino]-3-(3-nitrophenyl)thiourea CAS Name: 1-[[[2-hydroxy-3,5-di(propan-2-yl)phenyl]-oxomethyl]amino]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-[[2-hydroxy-3,5-di(propan-2-yl)benzoyl]amino]-3-(3-nitrophenyl)thiourea Traditional Name: 1-[(2-hydroxy-3,5-diisopropyl-benzoyl)amino]-3-(3-nitrophenyl)thiourea Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(=O)NNC(=S)NC2=CC(=CC=C2)[N+](=O)[O-])O)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(=O)NNC(=S)NC2=CC(=CC=C2)[N+](=O)[O-])O)C(C)C

InChI

InChI=1S/C20H24N4O4S/c1-11(2)13-8-16(12(3)4)18(25)17(9-13)19(26)22-23-20(29)21-14-6-5-7-15(10-14)24(27)28/h5-12,25H,1-4H3,(H,22,26)(H2,21,23,29)