1-butyl-3-[4-[2-[(5-chloranyl-2-methoxy-4-nitro-phenyl)sulfonylamino]ethyl]phenyl]sulfonyl-urea

Systemtic Name: 1-butyl-3-[4-[2-[(5-chloranyl-2-methoxy-4-nitro-phenyl)sulfonylamino]ethyl]phenyl]sulfonyl-urea Openeye Name: 1-butyl-3-[4-[2-[(5-chloro-2-methoxy-4-nitro-phenyl)sulfonylamino]ethyl]phenyl]sulfonyl-urea CAS Name: 1-butyl-3-[4-[2-[(5-chloro-2-methoxy-4-nitrophenyl)sulfonylamino]ethyl]phenyl]sulfonylurea IUPAC Name: 1-butyl-3-[4-[2-[(5-chloro-2-methoxy-4-nitrophenyl)sulfonylamino]ethyl]phenyl]sulfonylurea Traditional Name: 1-butyl-3-[4-[2-[(5-chloro-2-methoxy-4-nitro-phenyl)sulfonylamino]ethyl]phenyl]sulfonyl-urea Formula: C20H25ClN4O8S2 MolecularWeight: 549.0175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)CCNS(=O)(=O)C2=C(C=C(C(=C2)Cl)[N+](=O)[O-])OC

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)CCNS(=O)(=O)C2=C(C=C(C(=C2)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C20H25ClN4O8S2/c1-3-4-10-22-20(26)24-34(29,30)15-7-5-14(6-8-15)9-11-23-35(31,32)19-12-16(21)17(25(27)28)13-18(19)33-2/h5-8,12-13,23H,3-4,9-11H2,1-2H3,(H2,22,24,26)