5-[(4-chlorophenyl)methyl-methylsulfonyl-amino]-N-(furan-2-ylmethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[(4-chlorophenyl)methyl-methylsulfonyl-amino]-N-(furan-2-ylmethyl)-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-chlorophenyl)methyl-methylsulfonyl-amino]-N-(2-furylmethyl)benzothiophene-2-carboxamide CAS Name: 5-[(4-chlorophenyl)methyl-methylsulfonylamino]-N-(2-furanylmethyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-chlorophenyl)methyl-methylsulfonylamino]-N-(furan-2-ylmethyl)-1-benzothiophene-2-carboxamide Traditional Name: 5-[(4-chlorobenzyl)-mesyl-amino]-N-(2-furfuryl)benzothiophene-2-carboxamide Formula: C22H19ClN2O4S2 MolecularWeight: 474.98026

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)Cl)C2=CC3=C(C=C2)SC(=C3)C(=O)NCC4=CC=CO4

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)Cl)C2=CC3=C(C=C2)SC(=C3)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C22H19ClN2O4S2/c1-31(27,28)25(14-15-4-6-17(23)7-5-15)18-8-9-20-16(11-18)12-21(30-20)22(26)24-13-19-3-2-10-29-19/h2-12H,13-14H2,1H3,(H,24,26)