3-(2-methoxyphenyl)sulfanyl-N-methylsulfonyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: 3-(2-methoxyphenyl)sulfanyl-N-methylsulfonyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: 3-(2-methoxyphenyl)sulfanyl-N-methylsulfonyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: 3-[(2-methoxyphenyl)thio]-N-methylsulfonyl-N-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: 3-(2-methoxyphenyl)sulfanyl-N-methylsulfonyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: N-mesyl-3-[(2-methoxyphenyl)thio]-N-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C17H23N3O4S2 MolecularWeight: 397.51222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)N(C(=O)CCSC2=CC=CC=C2OC)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NN1C)C)N(C(=O)CCSC2=CC=CC=C2OC)S(=O)(=O)C

InChI

InChI=1S/C17H23N3O4S2/c1-12-17(13(2)19(3)18-12)20(26(5,22)23)16(21)10-11-25-15-9-7-6-8-14(15)24-4/h6-9H,10-11H2,1-5H3