2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-3-ethyl-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-ethyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-3-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C18H17N3OS3 MolecularWeight: 387.54208

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC3=NC4=CC=CC=C4S3)SC(=C2C)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC3=NC4=CC=CC=C4S3)SC(=C2C)C

InChI

InChI=1S/C18H17N3OS3/c1-4-21-17(22)15-10(2)11(3)24-16(15)20-18(21)23-9-14-19-12-7-5-6-8-13(12)25-14/h5-8H,4,9H2,1-3H3