2-(phenylmethyl)-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(phenylmethyl)-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 2-benzyl-3H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-(phenylmethyl)-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-benzyl-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 2-benzyl-3H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C17H12N2OS MolecularWeight: 292.35498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC3=C(C4=CC=CC=C4S3)C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC3=C(C4=CC=CC=C4S3)C(=O)N2

InChI

InChI=1S/C17H12N2OS/c20-16-15-12-8-4-5-9-13(12)21-17(15)19-14(18-16)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,18,19,20)