1-(4-bromanyl-2,6-dimethyl-phenyl)-3-[(2-pyrrol-1-ylphenyl)carbonylamino]thiourea

Systemtic Name: 1-(4-bromanyl-2,6-dimethyl-phenyl)-3-[(2-pyrrol-1-ylphenyl)carbonylamino]thiourea Openeye Name: 1-(4-bromo-2,6-dimethyl-phenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea CAS Name: 1-(4-bromo-2,6-dimethylphenyl)-3-[[oxo-[2-(1-pyrrolyl)phenyl]methyl]amino]thiourea IUPAC Name: 1-(4-bromo-2,6-dimethylphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea Traditional Name: 1-(4-bromo-2,6-dimethyl-phenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea Formula: C20H19BrN4OS MolecularWeight: 443.36006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=S)NNC(=O)C2=CC=CC=C2N3C=CC=C3)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=S)NNC(=O)C2=CC=CC=C2N3C=CC=C3)C)Br

InChI

InChI=1S/C20H19BrN4OS/c1-13-11-15(21)12-14(2)18(13)22-20(27)24-23-19(26)16-7-3-4-8-17(16)25-9-5-6-10-25/h3-12H,1-2H3,(H,23,26)(H2,22,24,27)