1-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-(4-nitrophenyl)urea

Systemtic Name: 1-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-(4-nitrophenyl)urea Openeye Name: 1-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-(4-nitrophenyl)urea CAS Name: 1-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-3-(4-nitrophenyl)urea Traditional Name: 1-(2-chloro-5-pyrrolidinosulfonyl-phenyl)-3-(4-nitrophenyl)urea Formula: C17H17ClN4O5S MolecularWeight: 424.85868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN4O5S/c18-15-8-7-14(28(26,27)21-9-1-2-10-21)11-16(15)20-17(23)19-12-3-5-13(6-4-12)22(24)25/h3-8,11H,1-2,9-10H2,(H2,19,20,23)