2-butyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-butyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-butyl-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-butyl-N-[(2S)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-butyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-butyl-1,3-diketo-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]isoindoline-5-carboxamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC(C3=CC=CS3)N4CCOCC4

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC[C@@H](C3=CC=CS3)N4CCOCC4

InChI

InChI=1S/C23H27N3O4S/c1-2-3-8-26-22(28)17-7-6-16(14-18(17)23(26)29)21(27)24-15-19(20-5-4-13-31-20)25-9-11-30-12-10-25/h4-7,13-14,19H,2-3,8-12,15H2,1H3,(H,24,27)/t19-/m0/s1