2-[[phenethyl-(phenylmethyl)amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[phenethyl-(phenylmethyl)amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[benzyl(phenethyl)amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[phenethyl-(phenylmethyl)amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[benzyl(phenethyl)amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[benzyl(phenethyl)amino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)CC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)CC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C22H21N3OS/c26-22-21-19(12-14-27-21)23-20(24-22)16-25(15-18-9-5-2-6-10-18)13-11-17-7-3-1-4-8-17/h1-10,12,14H,11,13,15-16H2,(H,23,24,26)