2-(dimethylaminomethyl)-8-(1-phenylethyl)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 2-(dimethylaminomethyl)-8-(1-phenylethyl)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 2-(dimethylaminomethyl)-8-(1-phenylethyl)-1H-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 2-(dimethylaminomethyl)-8-(1-phenylethyl)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 2-(dimethylaminomethyl)-8-(1-phenylethyl)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 2-(dimethylaminomethyl)-8-(1-phenylethyl)-1H-benzothiopheno[3,2-d]pyrimidin-4-one Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C2=CC3=C(C=C2)SC4=C3NC(=NC4=O)CN(C)C

Isomeric SMILES

CC(C1=CC=CC=C1)C2=CC3=C(C=C2)SC4=C3NC(=NC4=O)CN(C)C

InChI

InChI=1S/C21H21N3OS/c1-13(14-7-5-4-6-8-14)15-9-10-17-16(11-15)19-20(26-17)21(25)23-18(22-19)12-24(2)3/h4-11,13H,12H2,1-3H3,(H,22,23,25)