2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)ethanamide

Systemtic Name: 2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)ethanamide Openeye Name: 2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)acetamide CAS Name: 2-(5H-pyrimido[5,4-b]indol-4-ylthio)acetamide IUPAC Name: 2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)acetamide Traditional Name: 2-(5H-pyrimid[5,4-b]indol-4-ylthio)acetamide Formula: C12H10N4OS MolecularWeight: 258.299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(N2)C(=NC=N3)SCC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(N2)C(=NC=N3)SCC(=O)N

InChI

InChI=1S/C12H10N4OS/c13-9(17)5-18-12-11-10(14-6-15-12)7-3-1-2-4-8(7)16-11/h1-4,6,16H,5H2,(H2,13,17)