N-butylsulfonyl-N-(2,4-diisocyanato-5-methyl-phenyl)butane-1-sulfonamide

Systemtic Name: N-butylsulfonyl-N-(2,4-diisocyanato-5-methyl-phenyl)butane-1-sulfonamide Openeye Name: N-butylsulfonyl-N-(2,4-diisocyanato-5-methyl-phenyl)butane-1-sulfonamide CAS Name: N-butylsulfonyl-N-(2,4-diisocyanato-5-methylphenyl)-1-butanesulfonamide IUPAC Name: N-butylsulfonyl-N-(2,4-diisocyanato-5-methylphenyl)butane-1-sulfonamide Traditional Name: N-butylsulfonyl-N-(2,4-diisocyanato-5-methyl-phenyl)butane-1-sulfonamide Formula: C17H23N3O6S2 MolecularWeight: 429.51102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N(C1=C(C=C(C(=C1)C)N=C=O)N=C=O)S(=O)(=O)CCCC

Isomeric SMILES

CCCCS(=O)(=O)N(C1=C(C=C(C(=C1)C)N=C=O)N=C=O)S(=O)(=O)CCCC

InChI

InChI=1S/C17H23N3O6S2/c1-4-6-8-27(23,24)20(28(25,26)9-7-5-2)17-10-14(3)15(18-12-21)11-16(17)19-13-22/h10-11H,4-9H2,1-3H3