N-(4-methoxyphenyl)-4-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3-thiazol-2-amine

Systemtic Name: N-(4-methoxyphenyl)-4-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3-thiazol-2-amine Openeye Name: N-(4-methoxyphenyl)-4-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]thiazol-2-amine CAS Name: N-(4-methoxyphenyl)-4-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]-2-thiazolamine IUPAC Name: N-(4-methoxyphenyl)-4-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3-thiazol-2-amine Traditional Name: (4-methoxyphenyl)-[4-[[(5-pyrrolidinosulfonyl-2-pyridyl)thio]methyl]thiazol-2-yl]amine Formula: C20H22N4O3S3 MolecularWeight: 462.60868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=CS2)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=CS2)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H22N4O3S3/c1-27-17-6-4-15(5-7-17)22-20-23-16(14-29-20)13-28-19-9-8-18(12-21-19)30(25,26)24-10-2-3-11-24/h4-9,12,14H,2-3,10-11,13H2,1H3,(H,22,23)