3-[2-(1H-indol-3-yl)ethyl]-2-sulfanylidene-1H-pteridin-4-one

Systemtic Name: 3-[2-(1H-indol-3-yl)ethyl]-2-sulfanylidene-1H-pteridin-4-one Openeye Name: 3-[2-(1H-indol-3-yl)ethyl]-2-thioxo-1H-pteridin-4-one CAS Name: 3-[2-(1H-indol-3-yl)ethyl]-2-sulfanylidene-1H-pteridin-4-one IUPAC Name: 3-[2-(1H-indol-3-yl)ethyl]-2-sulfanylidene-1H-pteridin-4-one Traditional Name: 3-[2-(1H-indol-3-yl)ethyl]-2-thioxo-1H-pteridin-4-one Formula: C16H13N5OS MolecularWeight: 323.37232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCN3C(=O)C4=NC=CN=C4NC3=S

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCN3C(=O)C4=NC=CN=C4NC3=S

InChI

InChI=1S/C16H13N5OS/c22-15-13-14(18-7-6-17-13)20-16(23)21(15)8-5-10-9-19-12-4-2-1-3-11(10)12/h1-4,6-7,9,19H,5,8H2,(H,18,20,23)