N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-2-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-2-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-[2-(diethylamino)-2-(3-thienyl)ethyl]-2-methyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[2-(diethylamino)-2-(3-thiophenyl)ethyl]-2-methyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-[2-(diethylamino)-2-(3-thienyl)ethyl]-1,3-diketo-2-methyl-isoindoline-5-carboxamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C)C3=CSC=C3

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C)C3=CSC=C3

InChI

InChI=1S/C20H23N3O3S/c1-4-23(5-2)17(14-8-9-27-12-14)11-21-18(24)13-6-7-15-16(10-13)20(26)22(3)19(15)25/h6-10,12,17H,4-5,11H2,1-3H3,(H,21,24)