(2-thiophen-2-ylpyrrolidin-1-yl)-[4-(1,2,4-triazol-1-yl)phenyl]methanone

Systemtic Name: (2-thiophen-2-ylpyrrolidin-1-yl)-[4-(1,2,4-triazol-1-yl)phenyl]methanone Openeye Name: [2-(2-thienyl)pyrrolidin-1-yl]-[4-(1,2,4-triazol-1-yl)phenyl]methanone CAS Name: (2-thiophen-2-yl-1-pyrrolidinyl)-[4-(1,2,4-triazol-1-yl)phenyl]methanone IUPAC Name: (2-thiophen-2-ylpyrrolidin-1-yl)-[4-(1,2,4-triazol-1-yl)phenyl]methanone Traditional Name: [2-(2-thienyl)pyrrolidino]-[4-(1,2,4-triazol-1-yl)phenyl]methanone Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=C(C=C2)N3C=NC=N3)C4=CC=CS4

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC=C(C=C2)N3C=NC=N3)C4=CC=CS4

InChI

InChI=1S/C17H16N4OS/c22-17(20-9-1-3-15(20)16-4-2-10-23-16)13-5-7-14(8-6-13)21-12-18-11-19-21/h2,4-8,10-12,15H,1,3,9H2