3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]benzonitrile CAS Name: 3-[[(2,5,6-trimethyl-4-thieno[2,3-d]pyrimidinyl)thio]methyl]benzonitrile IUPAC Name: 3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]benzonitrile Traditional Name: 3-[[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)thio]methyl]benzonitrile Formula: C17H15N3S2 MolecularWeight: 325.4511

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC(=N2)C)SCC3=CC=CC(=C3)C#N)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC(=N2)C)SCC3=CC=CC(=C3)C#N)C

InChI

InChI=1S/C17H15N3S2/c1-10-11(2)22-17-15(10)16(19-12(3)20-17)21-9-14-6-4-5-13(7-14)8-18/h4-7H,9H2,1-3H3