N-[3-(1,3-benzothiazol-2-yl)propyl]-2-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]ethanamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]ethanamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-(1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1C(=O)N(C2=O)CC(=O)NCCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C=CCC2C1C(=O)N(C2=O)CC(=O)NCCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H21N3O3S/c24-17(12-23-19(25)13-6-1-2-7-14(13)20(23)26)21-11-5-10-18-22-15-8-3-4-9-16(15)27-18/h1-4,8-9,13-14H,5-7,10-12H2,(H,21,24)