1-tert-butyl-3-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]thiourea Openeye Name: 1-tert-butyl-3-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]thiourea CAS Name: 1-tert-butyl-3-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]thiourea Traditional Name: 1-tert-butyl-3-[(3-pyrrolidinosulfonylbenzoyl)amino]thiourea Formula: C16H24N4O3S2 MolecularWeight: 384.51676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C16H24N4O3S2/c1-16(2,3)17-15(24)19-18-14(21)12-7-6-8-13(11-12)25(22,23)20-9-4-5-10-20/h6-8,11H,4-5,9-10H2,1-3H3,(H,18,21)(H2,17,19,24)