N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-3-morpholinosulfonyl-benzamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-3-morpholinosulfonyl-benzamide Formula: C17H20N4O5S3 MolecularWeight: 456.5595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)SCC(=O)N

InChI

InChI=1S/C17H20N4O5S3/c1-11-16(27-10-14(18)22)28-17(19-11)20-15(23)12-3-2-4-13(9-12)29(24,25)21-5-7-26-8-6-21/h2-4,9H,5-8,10H2,1H3,(H2,18,22)(H,19,20,23)