2-[(3-ethyl-4-oxidanylidene-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-propyl-ethanamide

Systemtic Name: 2-[(3-ethyl-4-oxidanylidene-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-propyl-ethanamide Openeye Name: 2-[(3-ethyl-4-oxo-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-propyl-acetamide CAS Name: 2-[(3-ethyl-4-oxo-5H-pyrimido[5,4-b]indol-2-yl)thio]-N-propylacetamide IUPAC Name: 2-[(3-ethyl-4-oxo-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-propylacetamide Traditional Name: 2-[(3-ethyl-4-keto-5H-pyrimid[5,4-b]indol-2-yl)thio]-N-propyl-acetamide Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NC2=C(C(=O)N1CC)NC3=CC=CC=C32

Isomeric SMILES

CCCNC(=O)CSC1=NC2=C(C(=O)N1CC)NC3=CC=CC=C32

InChI

InChI=1S/C17H20N4O2S/c1-3-9-18-13(22)10-24-17-20-14-11-7-5-6-8-12(11)19-15(14)16(23)21(17)4-2/h5-8,19H,3-4,9-10H2,1-2H3,(H,18,22)