N-phenyl-4-[[4-phenyl-5-(3-pyrrolidin-1-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-2-amine

Systemtic Name: N-phenyl-4-[[4-phenyl-5-(3-pyrrolidin-1-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-2-amine Openeye Name: N-phenyl-4-[[4-phenyl-5-(3-pyrrolidin-1-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazol-2-amine CAS Name: N-phenyl-4-[[[4-phenyl-5-[3-(1-pyrrolidinylsulfonyl)phenyl]-1,2,4-triazol-3-yl]thio]methyl]-2-thiazolamine IUPAC Name: N-phenyl-4-[[4-phenyl-5-(3-pyrrolidin-1-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-2-amine Traditional Name: phenyl-[4-[[[4-phenyl-5-(3-pyrrolidinosulfonylphenyl)-1,2,4-triazol-3-yl]thio]methyl]thiazol-2-yl]amine Formula: C28H26N6O2S3 MolecularWeight: 574.74004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(N3C4=CC=CC=C4)SCC5=CSC(=N5)NC6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C3=NN=C(N3C4=CC=CC=C4)SCC5=CSC(=N5)NC6=CC=CC=C6

InChI

InChI=1S/C28H26N6O2S3/c35-39(36,33-16-7-8-17-33)25-15-9-10-21(18-25)26-31-32-28(34(26)24-13-5-2-6-14-24)38-20-23-19-37-27(30-23)29-22-11-3-1-4-12-22/h1-6,9-15,18-19H,7-8,16-17,20H2,(H,29,30)