3-phenylazanyl-4-[1-(3-thiomorpholin-4-ylpropyl)indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-phenylazanyl-4-[1-(3-thiomorpholin-4-ylpropyl)indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-anilino-4-[1-(3-thiomorpholinopropyl)indol-3-yl]pyrrole-2,5-dione CAS Name: 3-anilino-4-[1-(3-thiomorpholin-4-ylpropyl)-3-indolyl]pyrrole-2,5-dione IUPAC Name: 3-anilino-4-[1-(3-thiomorpholin-4-ylpropyl)indol-3-yl]pyrrole-2,5-dione Traditional Name: 3-anilino-4-[1-(3-thiomorpholinopropyl)indol-3-yl]-3-pyrroline-2,5-quinone Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1CCCN2C=C(C3=CC=CC=C32)C4=C(C(=O)NC4=O)NC5=CC=CC=C5

Isomeric SMILES

C1CSCCN1CCCN2C=C(C3=CC=CC=C32)C4=C(C(=O)NC4=O)NC5=CC=CC=C5

InChI

InChI=1S/C25H26N4O2S/c30-24-22(23(25(31)27-24)26-18-7-2-1-3-8-18)20-17-29(21-10-5-4-9-19(20)21)12-6-11-28-13-15-32-16-14-28/h1-5,7-10,17H,6,11-16H2,(H2,26,27,30,31)