3-[(6-ethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[(6-ethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[(3-allyl-6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[(6-ethyl-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[(6-ethyl-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[(3-allyl-6-ethyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]-N,N-dimethyl-benzenesulfonamide Formula: C20H23N3O3S3 MolecularWeight: 449.60992

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC3=CC(=CC=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC3=CC(=CC=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C20H23N3O3S3/c1-5-10-23-19(24)17-12-15(6-2)28-18(17)21-20(23)27-13-14-8-7-9-16(11-14)29(25,26)22(3)4/h5,7-9,11-12H,1,6,10,13H2,2-4H3