N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-butyl-N-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-butyl-N-methyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-butyl-N-methyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-butyl-N-methyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-butyl-N-methyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-butyl-1,3-diketo-N-methyl-isoindoline-5-carboxamide Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N(C)C(C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N(C)[C@H](C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H23N3O3S/c1-4-5-12-26-22(28)16-11-10-15(13-17(16)23(26)29)21(27)25(3)14(2)20-24-18-8-6-7-9-19(18)30-20/h6-11,13-14H,4-5,12H2,1-3H3/t14-/m1/s1