3-(1-benzothiophen-3-yl)-4-[1-(3-oxidanylpropyl)indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-(1-benzothiophen-3-yl)-4-[1-(3-oxidanylpropyl)indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-(benzothiophen-3-yl)-4-[1-(3-hydroxypropyl)indol-3-yl]pyrrole-2,5-dione CAS Name: 3-(1-benzothiophen-3-yl)-4-[1-(3-hydroxypropyl)-3-indolyl]pyrrole-2,5-dione IUPAC Name: 3-(1-benzothiophen-3-yl)-4-[1-(3-hydroxypropyl)indol-3-yl]pyrrole-2,5-dione Traditional Name: 3-(benzothiophen-3-yl)-4-[1-(3-hydroxypropyl)indol-3-yl]-3-pyrroline-2,5-quinone Formula: C23H18N2O3S MolecularWeight: 402.46562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCCO)C3=C(C(=O)NC3=O)C4=CSC5=CC=CC=C54

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCCO)C3=C(C(=O)NC3=O)C4=CSC5=CC=CC=C54

InChI

InChI=1S/C23H18N2O3S/c26-11-5-10-25-12-16(14-6-1-3-8-18(14)25)20-21(23(28)24-22(20)27)17-13-29-19-9-4-2-7-15(17)19/h1-4,6-9,12-13,26H,5,10-11H2,(H,24,27,28)