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

Systemtic Name: 5-[(4-bromophenyl)sulfonyl-ethyl-amino]-N-prop-2-enyl-1-benzothiophene-2-carboxamide Openeye Name: N-allyl-5-[(4-bromophenyl)sulfonyl-ethyl-amino]benzothiophene-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-prop-2-enyl-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonyl-ethylamino]-N-prop-2-enyl-1-benzothiophene-2-carboxamide Traditional Name: N-allyl-5-[brosyl(ethyl)amino]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)NCC=C)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)NCC=C)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

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