3-[[3-[bis(2-chloroethyl)amino]-4-methyl-phenyl]carbonylamino]benzenesulfonyl fluoride

Systemtic Name: 3-[[3-[bis(2-chloroethyl)amino]-4-methyl-phenyl]carbonylamino]benzenesulfonyl fluoride Openeye Name: 3-[[3-[bis(2-chloroethyl)amino]-4-methyl-benzoyl]amino]benzenesulfonyl fluoride CAS Name: 3-[[[3-[bis(2-chloroethyl)amino]-4-methylphenyl]-oxomethyl]amino]benzenesulfonyl fluoride IUPAC Name: 3-[[3-[bis(2-chloroethyl)amino]-4-methylbenzoyl]amino]benzenesulfonyl fluoride Traditional Name: 3-[[3-[bis(2-chloroethyl)amino]-4-methyl-benzoyl]amino]benzenesulfonyl fluoride Formula: C18H19Cl2FN2O3S MolecularWeight: 433.324463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)F)N(CCCl)CCCl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)F)N(CCCl)CCCl

InChI

InChI=1S/C18H19Cl2FN2O3S/c1-13-5-6-14(11-17(13)23(9-7-19)10-8-20)18(24)22-15-3-2-4-16(12-15)27(21,25)26/h2-6,11-12H,7-10H2,1H3,(H,22,24)