N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-(1-methyltetrazol-5-yl)sulfanyl-propanamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-[(1-methyl-5-tetrazolyl)thio]propanamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-(1-methyltetrazol-5-yl)sulfanylpropanamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-[(1-methyltetrazol-5-yl)thio]propionamide Formula: C16H22N6O4S2 MolecularWeight: 426.51368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=NN2C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=NN2C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C16H22N6O4S2/c1-11-4-5-13(10-14(11)28(24,25)22-6-8-26-9-7-22)17-15(23)12(2)27-16-18-19-20-21(16)3/h4-5,10,12H,6-9H2,1-3H3,(H,17,23)