2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethanone

Systemtic Name: 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethanone Openeye Name: 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone CAS Name: 1-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]-2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone Traditional Name: 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]thio]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone Formula: C21H23N5O2S2 MolecularWeight: 441.56962

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CN2)C(=O)CSC3=NN=C(S3)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CN2)C(=O)CSC3=NN=C(S3)NCCC4=CC=CC=C4

InChI

InChI=1S/C21H23N5O2S2/c27-18(16-12-17(23-13-16)19(28)26-10-4-5-11-26)14-29-21-25-24-20(30-21)22-9-8-15-6-2-1-3-7-15/h1-3,6-7,12-13,23H,4-5,8-11,14H2,(H,22,24)