N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-5-oxidanylidene-5-thiophen-2-yl-pentanamide

Systemtic Name: N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-5-oxidanylidene-5-thiophen-2-yl-pentanamide Openeye Name: N-[4-[4-(acetamidomethyl)phenyl]thiazol-2-yl]-5-oxo-5-(2-thienyl)pentanamide CAS Name: N-[4-[4-(acetamidomethyl)phenyl]-2-thiazolyl]-5-oxo-5-thiophen-2-ylpentanamide IUPAC Name: N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-5-oxo-5-thiophen-2-ylpentanamide Traditional Name: N-[4-[4-(acetamidomethyl)phenyl]thiazol-2-yl]-5-keto-5-(2-thienyl)valeramide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCCC(=O)C3=CC=CS3

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCCC(=O)C3=CC=CS3

InChI

InChI=1S/C21H21N3O3S2/c1-14(25)22-12-15-7-9-16(10-8-15)17-13-29-21(23-17)24-20(27)6-2-4-18(26)19-5-3-11-28-19/h3,5,7-11,13H,2,4,6,12H2,1H3,(H,22,25)(H,23,24,27)