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

Systemtic Name: 4-phenylsulfanyl-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]butanamide Openeye Name: 4-phenylsulfanyl-N-[4-(2,4,5-trimethylphenyl)thiazol-2-yl]butanamide CAS Name: 4-(phenylthio)-N-[4-(2,4,5-trimethylphenyl)-2-thiazolyl]butanamide IUPAC Name: 4-phenylsulfanyl-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]butanamide Traditional Name: 4-(phenylthio)-N-[4-(2,4,5-trimethylphenyl)thiazol-2-yl]butyramide Formula: C22H24N2OS2 MolecularWeight: 396.56876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=CSC(=N2)NC(=O)CCCSC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=CSC(=N2)NC(=O)CCCSC3=CC=CC=C3)C)C

InChI

InChI=1S/C22H24N2OS2/c1-15-12-17(3)19(13-16(15)2)20-14-27-22(23-20)24-21(25)10-7-11-26-18-8-5-4-6-9-18/h4-6,8-9,12-14H,7,10-11H2,1-3H3,(H,23,24,25)