N-[1-(phenylmethyl)pyrrolidin-3-yl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[1-(phenylmethyl)pyrrolidin-3-yl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-[1-(phenylmethyl)-3-pyrrolidinyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C19H21N5OS2 MolecularWeight: 399.53294

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)CN2C(=NNC2=S)C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC1NC(=O)CN2C(=NNC2=S)C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C19H21N5OS2/c25-17(13-24-18(21-22-19(24)26)16-7-4-10-27-16)20-15-8-9-23(12-15)11-14-5-2-1-3-6-14/h1-7,10,15H,8-9,11-13H2,(H,20,25)(H,22,26)