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

Systemtic Name: N-[4-methylsulfanyl-1-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methylamino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[3-methylsulfanyl-1-[[4-(2-methylthiazol-4-yl)phenyl]methylcarbamoyl]propyl]benzamide CAS Name: N-[1-[[4-(2-methyl-4-thiazolyl)phenyl]methylamino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[4-methylsulfanyl-1-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methylamino]-1-oxobutan-2-yl]benzamide Traditional Name: N-[1-[[4-(2-methylthiazol-4-yl)benzyl]carbamoyl]-3-(methylthio)propyl]benzamide Formula: C23H25N3O2S2 MolecularWeight: 439.5935

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)CNC(=O)C(CCSC)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)CNC(=O)C(CCSC)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H25N3O2S2/c1-16-25-21(15-30-16)18-10-8-17(9-11-18)14-24-23(28)20(12-13-29-2)26-22(27)19-6-4-3-5-7-19/h3-11,15,20H,12-14H2,1-2H3,(H,24,28)(H,26,27)