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

Systemtic Name: N-[4-(2-methylpropanoylamino)phenyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Openeye Name: N-[4-(2-methylpropanoylamino)phenyl]-4-[(4-methylthiazol-2-yl)sulfanylmethyl]benzamide CAS Name: N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-4-[[(4-methyl-2-thiazolyl)thio]methyl]benzamide IUPAC Name: N-[4-(2-methylpropanoylamino)phenyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Traditional Name: N-[4-(isobutyrylamino)phenyl]-4-[[(4-methylthiazol-2-yl)thio]methyl]benzamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)C(C)C

Isomeric SMILES

CC1=CSC(=N1)SCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)C(C)C

InChI

InChI=1S/C22H23N3O2S2/c1-14(2)20(26)24-18-8-10-19(11-9-18)25-21(27)17-6-4-16(5-7-17)13-29-22-23-15(3)12-28-22/h4-12,14H,13H2,1-3H3,(H,24,26)(H,25,27)