2-[5-azanyl-6-[(5-methoxy-1H-indol-3-yl)sulfanyl]hexyl]isoindole-1,3-dione

Systemtic Name: 2-[5-azanyl-6-[(5-methoxy-1H-indol-3-yl)sulfanyl]hexyl]isoindole-1,3-dione Openeye Name: 2-[5-amino-6-[(5-methoxy-1H-indol-3-yl)sulfanyl]hexyl]isoindoline-1,3-dione CAS Name: 2-[5-amino-6-[(5-methoxy-1H-indol-3-yl)thio]hexyl]isoindole-1,3-dione IUPAC Name: 2-[5-amino-6-[(5-methoxy-1H-indol-3-yl)sulfanyl]hexyl]isoindole-1,3-dione Traditional Name: 2-[5-amino-6-[(5-methoxy-1H-indol-3-yl)thio]hexyl]isoindoline-1,3-quinone Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2SCC(CCCCN3C(=O)C4=CC=CC=C4C3=O)N

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2SCC(CCCCN3C(=O)C4=CC=CC=C4C3=O)N

InChI

InChI=1S/C23H25N3O3S/c1-29-16-9-10-20-19(12-16)21(13-25-20)30-14-15(24)6-4-5-11-26-22(27)17-7-2-3-8-18(17)23(26)28/h2-3,7-10,12-13,15,25H,4-6,11,14,24H2,1H3