N-(cyclohexylmethyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-benzamide

Systemtic Name: N-(cyclohexylmethyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-benzamide Openeye Name: N-(cyclohexylmethyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-benzamide CAS Name: N-(cyclohexylmethyl)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]benzamide IUPAC Name: N-(cyclohexylmethyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylbenzamide Traditional Name: N-(cyclohexylmethyl)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]benzamide Formula: C22H25N3OS2 MolecularWeight: 411.5834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SC3=CC=CC=C3C(=O)NCC4CCCCC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SC3=CC=CC=C3C(=O)NCC4CCCCC4)C

InChI

InChI=1S/C22H25N3OS2/c1-14-15(2)27-21-19(14)22(25-13-24-21)28-18-11-7-6-10-17(18)20(26)23-12-16-8-4-3-5-9-16/h6-7,10-11,13,16H,3-5,8-9,12H2,1-2H3,(H,23,26)