1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-thiophen-2-yl-butane-1,4-dione

Systemtic Name: 1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-thiophen-2-yl-butane-1,4-dione Openeye Name: 1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-(2-thienyl)butane-1,4-dione CAS Name: 1-[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-4-thiophen-2-ylbutane-1,4-dione IUPAC Name: 1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-thiophen-2-ylbutane-1,4-dione Traditional Name: 1-[2-(1,3-benzothiazol-2-yl)pyrrolidino]-4-(2-thienyl)butane-1,4-dione Formula: C19H18N2O2S2 MolecularWeight: 370.48842

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC(=O)C2=CC=CS2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(N(C1)C(=O)CCC(=O)C2=CC=CS2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H18N2O2S2/c22-15(17-8-4-12-24-17)9-10-18(23)21-11-3-6-14(21)19-20-13-5-1-2-7-16(13)25-19/h1-2,4-5,7-8,12,14H,3,6,9-11H2