3-[1-(3-azanylpropyl)-2-(1-benzothiophen-2-yl)indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-[1-(3-azanylpropyl)-2-(1-benzothiophen-2-yl)indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-[1-(3-aminopropyl)-2-(benzothiophen-2-yl)indol-3-yl]pyrrole-2,5-dione CAS Name: 3-[1-(3-aminopropyl)-2-(1-benzothiophen-2-yl)-3-indolyl]pyrrole-2,5-dione IUPAC Name: 3-[1-(3-aminopropyl)-2-(1-benzothiophen-2-yl)indol-3-yl]pyrrole-2,5-dione Traditional Name: 3-[1-(3-aminopropyl)-2-(benzothiophen-2-yl)indol-3-yl]-3-pyrroline-2,5-quinone Formula: C23H19N3O2S MolecularWeight: 401.48086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)C3=C(C4=CC=CC=C4N3CCCN)C5=CC(=O)NC5=O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)C3=C(C4=CC=CC=C4N3CCCN)C5=CC(=O)NC5=O

InChI

InChI=1S/C23H19N3O2S/c24-10-5-11-26-17-8-3-2-7-15(17)21(16-13-20(27)25-23(16)28)22(26)19-12-14-6-1-4-9-18(14)29-19/h1-4,6-9,12-13H,5,10-11,24H2,(H,25,27,28)