N-(3-morpholin-4-ylpropyl)-1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]pyrrolidine-2-carboxamide

Systemtic Name: N-(3-morpholin-4-ylpropyl)-1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]pyrrolidine-2-carboxamide Openeye Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-morpholinopropyl)pyrrolidine-2-carboxamide CAS Name: N-[3-(4-morpholinyl)propyl]-1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-morpholin-4-ylpropyl)pyrrolidine-2-carboxamide Traditional Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-morpholinopropyl)pyrrolidine-2-carboxamide Formula: C21H29N5O2S MolecularWeight: 415.55226

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC(=NS2)CC3=CC=CC=C3)C(=O)NCCCN4CCOCC4

Isomeric SMILES

C1CC(N(C1)C2=NC(=NS2)CC3=CC=CC=C3)C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C21H29N5O2S/c27-20(22-9-5-10-25-12-14-28-15-13-25)18-8-4-11-26(18)21-23-19(24-29-21)16-17-6-2-1-3-7-17/h1-3,6-7,18H,4-5,8-16H2,(H,22,27)