N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-4-(phenylmethyl)sulfonyl-butanamide

Systemtic Name: N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-4-(phenylmethyl)sulfonyl-butanamide Openeye Name: 4-benzylsulfonyl-N-[4-(4-methoxyphenyl)-5-methyl-thiazol-2-yl]butanamide CAS Name: N-[4-(4-methoxyphenyl)-5-methyl-2-thiazolyl]-4-(phenylmethyl)sulfonylbutanamide IUPAC Name: 4-benzylsulfonyl-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]butanamide Traditional Name: 4-benzylsulfonyl-N-[4-(4-methoxyphenyl)-5-methyl-thiazol-2-yl]butyramide Formula: C22H24N2O4S2 MolecularWeight: 444.56696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)CCCS(=O)(=O)CC2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)CCCS(=O)(=O)CC2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H24N2O4S2/c1-16-21(18-10-12-19(28-2)13-11-18)24-22(29-16)23-20(25)9-6-14-30(26,27)15-17-7-4-3-5-8-17/h3-5,7-8,10-13H,6,9,14-15H2,1-2H3,(H,23,24,25)