N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-4-phenylsulfanyl-butanamide

Systemtic Name: N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-4-phenylsulfanyl-butanamide Openeye Name: N-[4-(4-acetamidophenyl)thiazol-2-yl]-4-phenylsulfanyl-butanamide CAS Name: N-[4-(4-acetamidophenyl)-2-thiazolyl]-4-(phenylthio)butanamide IUPAC Name: N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-4-phenylsulfanylbutanamide Traditional Name: N-[4-(4-acetamidophenyl)thiazol-2-yl]-4-(phenylthio)butyramide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCCSC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCCSC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S2/c1-15(25)22-17-11-9-16(10-12-17)19-14-28-21(23-19)24-20(26)8-5-13-27-18-6-3-2-4-7-18/h2-4,6-7,9-12,14H,5,8,13H2,1H3,(H,22,25)(H,23,24,26)