1-(2-chloroethyl)-3-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]urea

Systemtic Name: 1-(2-chloroethyl)-3-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]urea Openeye Name: 1-(2-chloroethyl)-3-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]urea CAS Name: 1-(2-chloroethyl)-3-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]urea IUPAC Name: 1-(2-chloroethyl)-3-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]urea Traditional Name: 1-(2-chloroethyl)-3-[(3-pyrrolidinosulfonylbenzoyl)amino]urea Formula: C14H19ClN4O4S MolecularWeight: 374.84306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)NCCCl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)NCCCl

InChI

InChI=1S/C14H19ClN4O4S/c15-6-7-16-14(21)18-17-13(20)11-4-3-5-12(10-11)24(22,23)19-8-1-2-9-19/h3-5,10H,1-2,6-9H2,(H,17,20)(H2,16,18,21)