1-(2-chloroethyl)-3-[(2-morpholin-4-ylsulfonyl-4-nitro-phenyl)amino]urea

Systemtic Name: 1-(2-chloroethyl)-3-[(2-morpholin-4-ylsulfonyl-4-nitro-phenyl)amino]urea Openeye Name: 1-(2-chloroethyl)-3-(2-morpholinosulfonyl-4-nitro-anilino)urea CAS Name: 1-(2-chloroethyl)-3-[2-(4-morpholinylsulfonyl)-4-nitroanilino]urea IUPAC Name: 1-(2-chloroethyl)-3-(2-morpholin-4-ylsulfonyl-4-nitroanilino)urea Traditional Name: 1-(2-chloroethyl)-3-(2-morpholinosulfonyl-4-nitro-anilino)urea Formula: C13H18ClN5O6S MolecularWeight: 407.82992

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NNC(=O)NCCCl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NNC(=O)NCCCl

InChI

InChI=1S/C13H18ClN5O6S/c14-3-4-15-13(20)17-16-11-2-1-10(19(21)22)9-12(11)26(23,24)18-5-7-25-8-6-18/h1-2,9,16H,3-8H2,(H2,15,17,20)