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

Systemtic Name: N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-4-phenylsulfanyl-butanamide Openeye Name: N-[4-(4-methoxyphenyl)-5-methyl-thiazol-2-yl]-4-phenylsulfanyl-butanamide CAS Name: N-[4-(4-methoxyphenyl)-5-methyl-2-thiazolyl]-4-(phenylthio)butanamide IUPAC Name: N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-4-phenylsulfanylbutanamide Traditional Name: N-[4-(4-methoxyphenyl)-5-methyl-thiazol-2-yl]-4-(phenylthio)butyramide Formula: C21H22N2O2S2 MolecularWeight: 398.54158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)CCCSC2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)CCCSC2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O2S2/c1-15-20(16-10-12-17(25-2)13-11-16)23-21(27-15)22-19(24)9-6-14-26-18-7-4-3-5-8-18/h3-5,7-8,10-13H,6,9,14H2,1-2H3,(H,22,23,24)