3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: 3-[(2-methylthiazol-4-yl)methylsulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: 3-[(2-methyl-4-thiazolyl)methylthio]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 3-[(2-methylthiazol-4-yl)methylthio]-N-(3-pyrrolidinosulfonylphenyl)propionamide Formula: C18H23N3O3S3 MolecularWeight: 425.58852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSCCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=NC(=CS1)CSCCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H23N3O3S3/c1-14-19-16(13-26-14)12-25-10-7-18(22)20-15-5-4-6-17(11-15)27(23,24)21-8-2-3-9-21/h4-6,11,13H,2-3,7-10,12H2,1H3,(H,20,22)