N-[4-(methylsulfanylmethyl)-1,3-thiazol-2-yl]-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[4-(methylsulfanylmethyl)-1,3-thiazol-2-yl]-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[4-(methylsulfanylmethyl)thiazol-2-yl]-4-morpholinosulfonyl-benzamide CAS Name: N-[4-[(methylthio)methyl]-2-thiazolyl]-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[4-(methylsulfanylmethyl)-1,3-thiazol-2-yl]-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[4-[(methylthio)methyl]thiazol-2-yl]-4-morpholinosulfonyl-benzamide Formula: C16H19N3O4S3 MolecularWeight: 413.53476

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CSC(=N1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CSCC1=CSC(=N1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C16H19N3O4S3/c1-24-10-13-11-25-16(17-13)18-15(20)12-2-4-14(5-3-12)26(21,22)19-6-8-23-9-7-19/h2-5,11H,6-10H2,1H3,(H,17,18,20)