2-(4-ethylphenyl)-4-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3-thiazole

Systemtic Name: 2-(4-ethylphenyl)-4-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3-thiazole Openeye Name: 2-(4-ethylphenyl)-4-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]thiazole CAS Name: 2-(4-ethylphenyl)-4-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]thiazole IUPAC Name: 2-(4-ethylphenyl)-4-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3-thiazole Traditional Name: 2-(4-ethylphenyl)-4-[[(5-pyrrolidinosulfonyl-2-pyridyl)thio]methyl]thiazole Formula: C21H23N3O2S3 MolecularWeight: 445.62122

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H23N3O2S3/c1-2-16-5-7-17(8-6-16)21-23-18(15-28-21)14-27-20-10-9-19(13-22-20)29(25,26)24-11-3-4-12-24/h5-10,13,15H,2-4,11-12,14H2,1H3