[1-[2-(chloromethyl)-3H-benzimidazol-5-yl]-4-methylsulfonyl-butyl]carbamic acid

Systemtic Name: [1-[2-(chloromethyl)-3H-benzimidazol-5-yl]-4-methylsulfonyl-butyl]carbamic acid Openeye Name: [1-[2-(chloromethyl)-3H-benzimidazol-5-yl]-4-methylsulfonyl-butyl]carbamic acid CAS Name: [1-[2-(chloromethyl)-3H-benzimidazol-5-yl]-4-methylsulfonylbutyl]carbamic acid IUPAC Name: [1-[2-(chloromethyl)-3H-benzimidazol-5-yl]-4-methylsulfonylbutyl]carbamic acid Traditional Name: [1-[2-(chloromethyl)-3H-benzimidazol-5-yl]-4-mesyl-butyl]carbamic acid Formula: C14H18ClN3O4S MolecularWeight: 359.82842

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCCC(C1=CC2=C(C=C1)N=C(N2)CCl)NC(=O)O

Isomeric SMILES

CS(=O)(=O)CCCC(C1=CC2=C(C=C1)N=C(N2)CCl)NC(=O)O

InChI

InChI=1S/C14H18ClN3O4S/c1-23(21,22)6-2-3-10(18-14(19)20)9-4-5-11-12(7-9)17-13(8-15)16-11/h4-5,7,10,18H,2-3,6,8H2,1H3,(H,16,17)(H,19,20)