[1-(4-methylphenyl)-5-(pyrimidin-2-ylsulfanylmethyl)-1,2,3-triazol-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-(4-methylphenyl)-5-(pyrimidin-2-ylsulfanylmethyl)-1,2,3-triazol-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-(p-tolyl)-5-(pyrimidin-2-ylsulfanylmethyl)triazol-4-yl]-pyrrolidin-1-yl-methanone CAS Name: [1-(4-methylphenyl)-5-[(2-pyrimidinylthio)methyl]-4-triazolyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-(4-methylphenyl)-5-(pyrimidin-2-ylsulfanylmethyl)triazol-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-(p-tolyl)-5-[(2-pyrimidylthio)methyl]triazol-4-yl]-pyrrolidino-methanone Formula: C19H20N6OS MolecularWeight: 380.4667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)N3CCCC3)CSC4=NC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)N3CCCC3)CSC4=NC=CC=N4

InChI

InChI=1S/C19H20N6OS/c1-14-5-7-15(8-6-14)25-16(13-27-19-20-9-4-10-21-19)17(22-23-25)18(26)24-11-2-3-12-24/h4-10H,2-3,11-13H2,1H3