4-[[4-(3-chlorophenyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-5-methyl-2-phenyl-1,3-oxazole

Systemtic Name: 4-[[4-(3-chlorophenyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-5-methyl-2-phenyl-1,3-oxazole Openeye Name: 4-[[4-(3-chlorophenyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-5-methyl-2-phenyl-oxazole CAS Name: 4-[[[4-(3-chlorophenyl)-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]methyl]-5-methyl-2-phenyloxazole IUPAC Name: 4-[[4-(3-chlorophenyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-5-methyl-2-phenyl-1,3-oxazole Traditional Name: 4-[[[4-(3-chlorophenyl)-5-pyrrolidino-1,2,4-triazol-3-yl]thio]methyl]-5-methyl-2-phenyl-oxazole Formula: C23H22ClN5OS MolecularWeight: 451.97168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)CSC3=NN=C(N3C4=CC(=CC=C4)Cl)N5CCCC5

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CSC3=NN=C(N3C4=CC(=CC=C4)Cl)N5CCCC5

InChI

InChI=1S/C23H22ClN5OS/c1-16-20(25-21(30-16)17-8-3-2-4-9-17)15-31-23-27-26-22(28-12-5-6-13-28)29(23)19-11-7-10-18(24)14-19/h2-4,7-11,14H,5-6,12-13,15H2,1H3