5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-cyclopropyl-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-cyclopropyl-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-cyclopropyl-benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-cyclopropyl-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-cyclopropyl-1-benzothiophene-2-carboxamide Traditional Name: 5-[brosyl(ethyl)amino]-N-cyclopropyl-benzothiophene-2-carboxamide Formula: C20H19BrN2O3S2 MolecularWeight: 479.41046

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3CC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NC3CC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H19BrN2O3S2/c1-2-23(28(25,26)17-8-3-14(21)4-9-17)16-7-10-18-13(11-16)12-19(27-18)20(24)22-15-5-6-15/h3-4,7-12,15H,2,5-6H2,1H3,(H,22,24)