N-[1-(1,3-benzothiazol-2-ylmethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[1-(1,3-benzothiazol-2-ylmethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[1-(1,3-benzothiazol-2-ylmethylcarbamoyl)-3-methylsulfanyl-propyl]benzamide CAS Name: N-[1-(1,3-benzothiazol-2-ylmethylamino)-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[1-(1,3-benzothiazol-2-ylmethylamino)-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[1-(1,3-benzothiazol-2-ylmethylcarbamoyl)-3-(methylthio)propyl]benzamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=NC2=CC=CC=C2S1)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CSCCC(C(=O)NCC1=NC2=CC=CC=C2S1)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2S2/c1-26-12-11-16(23-19(24)14-7-3-2-4-8-14)20(25)21-13-18-22-15-9-5-6-10-17(15)27-18/h2-10,16H,11-13H2,1H3,(H,21,25)(H,23,24)