2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-methylpyrrol-3-yl)ethanone

Systemtic Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-methylpyrrol-3-yl)ethanone Openeye Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-methylpyrrol-3-yl)ethanone CAS Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-1-(1-methyl-3-pyrrolyl)ethanone IUPAC Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-methylpyrrol-3-yl)ethanone Traditional Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-1-(1-methylpyrrol-3-yl)ethanone Formula: C15H18N4OS MolecularWeight: 302.39462

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)C(=O)CSC2=NN=C(N2C3CC3)C4CC4

Isomeric SMILES

CN1C=CC(=C1)C(=O)CSC2=NN=C(N2C3CC3)C4CC4

InChI

InChI=1S/C15H18N4OS/c1-18-7-6-11(8-18)13(20)9-21-15-17-16-14(10-2-3-10)19(15)12-4-5-12/h6-8,10,12H,2-5,9H2,1H3