N-[2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethyl]benzenesulfonamide

Systemtic Name: N-[2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethyl]benzenesulfonamide Openeye Name: N-[2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethyl]benzenesulfonamide CAS Name: N-[2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)thio]ethyl]benzenesulfonamide IUPAC Name: N-[2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethyl]benzenesulfonamide Traditional Name: N-[2-[(5-propyl-[1,2,4]triazin[5,6-b]indol-3-yl)thio]ethyl]benzenesulfonamide Formula: C20H21N5O2S2 MolecularWeight: 427.54304

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCCNS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCCNS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H21N5O2S2/c1-2-13-25-17-11-7-6-10-16(17)18-19(25)22-20(24-23-18)28-14-12-21-29(26,27)15-8-4-3-5-9-15/h3-11,21H,2,12-14H2,1H3