1-tert-butyl-3-[(2-pyrrol-1-ylphenyl)carbonylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[(2-pyrrol-1-ylphenyl)carbonylamino]thiourea Openeye Name: 1-tert-butyl-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea CAS Name: 1-tert-butyl-3-[[oxo-[2-(1-pyrrolyl)phenyl]methyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea Traditional Name: 1-tert-butyl-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)C1=CC=CC=C1N2C=CC=C2

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)C1=CC=CC=C1N2C=CC=C2

InChI

InChI=1S/C16H20N4OS/c1-16(2,3)17-15(22)19-18-14(21)12-8-4-5-9-13(12)20-10-6-7-11-20/h4-11H,1-3H3,(H,18,21)(H2,17,19,22)