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

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methyl-3-morpholinosulfonyl-phenyl)propanamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(4-methyl-3-morpholinosulfonyl-phenyl)propionamide Formula: C20H27N5O4S2 MolecularWeight: 465.58948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=C(N2CC=C)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=C(N2CC=C)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H27N5O4S2/c1-5-8-25-16(4)22-23-20(25)30-15(3)19(26)21-17-7-6-14(2)18(13-17)31(27,28)24-9-11-29-12-10-24/h5-7,13,15H,1,8-12H2,2-4H3,(H,21,26)