(E)-N-[2-[methylcarbamothioyl-[4-(oxan-2-ylmethoxy)phenyl]sulfonyl-amino]ethyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[2-[methylcarbamothioyl-[4-(oxan-2-ylmethoxy)phenyl]sulfonyl-amino]ethyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[2-[methylcarbamothioyl-[4-(tetrahydropyran-2-ylmethoxy)phenyl]sulfonyl-amino]ethyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[2-[[methylamino(sulfanylidene)methyl]-[4-(2-oxanylmethoxy)phenyl]sulfonylamino]ethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[2-[methylcarbamothioyl-[4-(oxan-2-ylmethoxy)phenyl]sulfonylamino]ethyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[2-[methylthiocarbamoyl-[4-(tetrahydropyran-2-ylmethoxy)phenyl]sulfonyl-amino]ethyl]-3-(2-thienyl)acrylamide Formula: C23H29N3O5S3 MolecularWeight: 523.68846

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N(CCNC(=O)C=CC1=CC=CS1)S(=O)(=O)C2=CC=C(C=C2)OCC3CCCCO3

Isomeric SMILES

CNC(=S)N(CCNC(=O)/C=C/C1=CC=CS1)S(=O)(=O)C2=CC=C(C=C2)OCC3CCCCO3

InChI

InChI=1S/C23H29N3O5S3/c1-24-23(32)26(14-13-25-22(27)12-9-20-6-4-16-33-20)34(28,29)21-10-7-18(8-11-21)31-17-19-5-2-3-15-30-19/h4,6-12,16,19H,2-3,5,13-15,17H2,1H3,(H,24,32)(H,25,27)/b12-9+