5-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-(phenylsulfonyl)thiophene-2-carboxamide

Systemtic Name: 5-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-(phenylsulfonyl)thiophene-2-carboxamide Openeye Name: N-(benzenesulfonyl)-5-[(2-benzyloxy-5-bromo-phenyl)methyl-ethyl-amino]thiophene-2-carboxamide CAS Name: N-(benzenesulfonyl)-5-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-2-thiophenecarboxamide IUPAC Name: N-(benzenesulfonyl)-5-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]thiophene-2-carboxamide Traditional Name: 5-[(2-benzoxy-5-bromo-benzyl)-ethyl-amino]-N-besyl-thiophene-2-carboxamide Formula: C27H25BrN2O4S2 MolecularWeight: 585.5324

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=CC=C(S3)C(=O)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=CC=C(S3)C(=O)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H25BrN2O4S2/c1-2-30(18-21-17-22(28)13-14-24(21)34-19-20-9-5-3-6-10-20)26-16-15-25(35-26)27(31)29-36(32,33)23-11-7-4-8-12-23/h3-17H,2,18-19H2,1H3,(H,29,31)