4-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-[(4-methylphenoxy)methyl]-1,3-thiazole

Systemtic Name: 4-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-[(4-methylphenoxy)methyl]-1,3-thiazole Openeye Name: 4-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-[(4-methylphenoxy)methyl]thiazole CAS Name: 4-[[[4-cyclopropyl-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]methyl]-2-[(4-methylphenoxy)methyl]thiazole IUPAC Name: 4-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-[(4-methylphenoxy)methyl]-1,3-thiazole Traditional Name: 4-[[(4-cyclopropyl-5-pyrrolidino-1,2,4-triazol-3-yl)thio]methyl]-2-[(4-methylphenoxy)methyl]thiazole Formula: C21H25N5OS2 MolecularWeight: 427.5861

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=NC(=CS2)CSC3=NN=C(N3C4CC4)N5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=NC(=CS2)CSC3=NN=C(N3C4CC4)N5CCCC5

InChI

InChI=1S/C21H25N5OS2/c1-15-4-8-18(9-5-15)27-12-19-22-16(13-28-19)14-29-21-24-23-20(25-10-2-3-11-25)26(21)17-6-7-17/h4-5,8-9,13,17H,2-3,6-7,10-12,14H2,1H3