N,N-diethyl-2-(9H-pyrimido[4,5-b]indol-2-ylsulfanyl)ethanamide

Systemtic Name: N,N-diethyl-2-(9H-pyrimido[4,5-b]indol-2-ylsulfanyl)ethanamide Openeye Name: N,N-diethyl-2-(9H-pyrimido[4,5-b]indol-2-ylsulfanyl)acetamide CAS Name: N,N-diethyl-2-(9H-pyrimido[4,5-b]indol-2-ylthio)acetamide IUPAC Name: N,N-diethyl-2-(9H-pyrimido[4,5-b]indol-2-ylsulfanyl)acetamide Traditional Name: N,N-diethyl-2-(9H-pyrimid[4,5-b]indol-2-ylthio)acetamide Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NC=C2C3=CC=CC=C3NC2=N1

Isomeric SMILES

CCN(CC)C(=O)CSC1=NC=C2C3=CC=CC=C3NC2=N1

InChI

InChI=1S/C16H18N4OS/c1-3-20(4-2)14(21)10-22-16-17-9-12-11-7-5-6-8-13(11)18-15(12)19-16/h5-9H,3-4,10H2,1-2H3,(H,17,18,19)