1-(2-pyrrolidin-1-ylethyl)-4H-[1]benzothiolo[2,3-b]pyrazine-2,3-dione

Systemtic Name: 1-(2-pyrrolidin-1-ylethyl)-4H-[1]benzothiolo[2,3-b]pyrazine-2,3-dione Openeye Name: 1-(2-pyrrolidin-1-ylethyl)-4H-benzothiopheno[2,3-b]pyrazine-2,3-dione CAS Name: 1-[2-(1-pyrrolidinyl)ethyl]-4H-[1]benzothiolo[2,3-b]pyrazine-2,3-dione IUPAC Name: 1-(2-pyrrolidin-1-ylethyl)-4H-[1]benzothiolo[2,3-b]pyrazine-2,3-dione Traditional Name: 1-(2-pyrrolidinoethyl)-4H-benzothiopheno[2,3-b]pyrazine-2,3-quinone Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCN2C3=C(NC(=O)C2=O)SC4=CC=CC=C43

Isomeric SMILES

C1CCN(C1)CCN2C3=C(NC(=O)C2=O)SC4=CC=CC=C43

InChI

InChI=1S/C16H17N3O2S/c20-14-16(21)19(10-9-18-7-3-4-8-18)13-11-5-1-2-6-12(11)22-15(13)17-14/h1-2,5-6H,3-4,7-10H2,(H,17,20)