1-(4-bromanyl-2,6-dimethyl-phenyl)-3-(9H-xanthen-9-ylcarbonylamino)thiourea

Systemtic Name: 1-(4-bromanyl-2,6-dimethyl-phenyl)-3-(9H-xanthen-9-ylcarbonylamino)thiourea Openeye Name: 1-(4-bromo-2,6-dimethyl-phenyl)-3-(9H-xanthene-9-carbonylamino)thiourea CAS Name: 1-(4-bromo-2,6-dimethylphenyl)-3-[[oxo(9H-xanthen-9-yl)methyl]amino]thiourea IUPAC Name: 1-(4-bromo-2,6-dimethylphenyl)-3-(9H-xanthene-9-carbonylamino)thiourea Traditional Name: 1-(4-bromo-2,6-dimethyl-phenyl)-3-(9H-xanthene-9-carbonylamino)thiourea Formula: C23H20BrN3O2S MolecularWeight: 482.3928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=S)NNC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=S)NNC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C)Br

InChI

InChI=1S/C23H20BrN3O2S/c1-13-11-15(24)12-14(2)21(13)25-23(30)27-26-22(28)20-16-7-3-5-9-18(16)29-19-10-6-4-8-17(19)20/h3-12,20H,1-2H3,(H,26,28)(H2,25,27,30)