S-azanyl N-[5-[2-[(5-bromanyl-2-methoxy-phenyl)carbonylamino]ethyl]thiophen-2-yl]sulfonylcarbamothioate

Systemtic Name: S-azanyl N-[5-[2-[(5-bromanyl-2-methoxy-phenyl)carbonylamino]ethyl]thiophen-2-yl]sulfonylcarbamothioate Openeye Name: S-amino N-[[5-[2-[(5-bromo-2-methoxy-benzoyl)amino]ethyl]-2-thienyl]sulfonyl]carbamothioate CAS Name: N-[[5-[2-[[(5-bromo-2-methoxyphenyl)-oxomethyl]amino]ethyl]-2-thiophenyl]sulfonyl]carbamothioic acid S-amino ester IUPAC Name: S-amino N-[5-[2-[(5-bromo-2-methoxybenzoyl)amino]ethyl]thiophen-2-yl]sulfonylcarbamothioate Traditional Name: N-[[5-[2-[(5-bromo-2-methoxy-benzoyl)amino]ethyl]-2-thienyl]sulfonyl]thiocarbamic acid S-amino ester Formula: C15H16BrN3O5S3 MolecularWeight: 494.40364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NCCC2=CC=C(S2)S(=O)(=O)NC(=O)SN

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NCCC2=CC=C(S2)S(=O)(=O)NC(=O)SN

InChI

InChI=1S/C15H16BrN3O5S3/c1-24-12-4-2-9(16)8-11(12)14(20)18-7-6-10-3-5-13(25-10)27(22,23)19-15(21)26-17/h2-5,8H,6-7,17H2,1H3,(H,18,20)(H,19,21)