2-(1,3-benzothiazol-2-ylmethylsulfanyl)-6-ethyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-6-ethyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-6-ethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-6-ethyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-6-ethyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-(1,3-benzothiazol-2-ylmethylthio)-6-ethyl-thieno[2,3-d]pyrimidin-4-one Formula: C19H17N3OS3 MolecularWeight: 399.55278

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H17N3OS3/c1-3-9-22-18(23)13-10-12(4-2)25-17(13)21-19(22)24-11-16-20-14-7-5-6-8-15(14)26-16/h3,5-8,10H,1,4,9,11H2,2H3