O-quinoxalin-6-yl 3-phenylpyrrolidine-1-carbothioate

Systemtic Name: O-quinoxalin-6-yl 3-phenylpyrrolidine-1-carbothioate Openeye Name: O-quinoxalin-6-yl 3-phenylpyrrolidine-1-carbothioate CAS Name: 3-phenyl-1-pyrrolidinecarbothioic acid O-(6-quinoxalinyl) ester IUPAC Name: O-quinoxalin-6-yl 3-phenylpyrrolidine-1-carbothioate Traditional Name: 3-phenylpyrrolidine-1-carbothioic acid O-quinoxalin-6-yl ester Formula: C19H17N3OS MolecularWeight: 335.42278

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1C2=CC=CC=C2)C(=S)OC3=CC4=NC=CN=C4C=C3

Isomeric SMILES

C1CN(CC1C2=CC=CC=C2)C(=S)OC3=CC4=NC=CN=C4C=C3

InChI

InChI=1S/C19H17N3OS/c24-19(22-11-8-15(13-22)14-4-2-1-3-5-14)23-16-6-7-17-18(12-16)21-10-9-20-17/h1-7,9-10,12,15H,8,11,13H2