N-[4-(3-methylbutanoylamino)phenyl]-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide

Systemtic Name: N-[4-(3-methylbutanoylamino)phenyl]-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide Openeye Name: N-[4-(3-methylbutanoylamino)phenyl]-4-[(2-methylthiazol-4-yl)methylsulfanyl]benzamide CAS Name: N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-4-[(2-methyl-4-thiazolyl)methylthio]benzamide IUPAC Name: N-[4-(3-methylbutanoylamino)phenyl]-4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzamide Traditional Name: N-[4-(isovalerylamino)phenyl]-4-[(2-methylthiazol-4-yl)methylthio]benzamide Formula: C23H25N3O2S2 MolecularWeight: 439.5935

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)CC(C)C

Isomeric SMILES

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)CC(C)C

InChI

InChI=1S/C23H25N3O2S2/c1-15(2)12-22(27)25-18-6-8-19(9-7-18)26-23(28)17-4-10-21(11-5-17)30-14-20-13-29-16(3)24-20/h4-11,13,15H,12,14H2,1-3H3,(H,25,27)(H,26,28)