2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-[(2-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(3-phenylpropyl)acetamide CAS Name: 2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)thio]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(3-phenylpropyl)acetamide Traditional Name: 2-[(2-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl)thio]-N-(3-phenylpropyl)acetamide Formula: C22H25N3OS2 MolecularWeight: 411.5834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C3=C(S2)CCCC3)C(=N1)SCC(=O)NCCCC4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C3=C(S2)CCCC3)C(=N1)SCC(=O)NCCCC4=CC=CC=C4

InChI

InChI=1S/C22H25N3OS2/c1-15-24-21(20-17-11-5-6-12-18(17)28-22(20)25-15)27-14-19(26)23-13-7-10-16-8-3-2-4-9-16/h2-4,8-9H,5-7,10-14H2,1H3,(H,23,26)