5-[(2-azanyl-3-sulfanyl-propoxy)methyl]-N-[1-(furan-2-ylmethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-propan-2-yl-benzamide

Systemtic Name: 5-[(2-azanyl-3-sulfanyl-propoxy)methyl]-N-[1-(furan-2-ylmethylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-propan-2-yl-benzamide Openeye Name: 5-[(2-amino-3-sulfanyl-propoxy)methyl]-N-[1-(2-furylmethylcarbamoyl)-3-methylsulfanyl-propyl]-2-isopropyl-benzamide CAS Name: 5-[(2-amino-3-mercaptopropoxy)methyl]-N-[1-(2-furanylmethylamino)-4-(methylthio)-1-oxobutan-2-yl]-2-propan-2-ylbenzamide IUPAC Name: 5-[(2-amino-3-sulfanylpropoxy)methyl]-N-[1-(furan-2-ylmethylamino)-4-methylsulfanyl-1-oxobutan-2-yl]-2-propan-2-ylbenzamide Traditional Name: 5-[(2-amino-3-mercapto-propoxy)methyl]-N-[1-(2-furfurylcarbamoyl)-3-(methylthio)propyl]-2-isopropyl-benzamide Formula: C24H35N3O4S2 MolecularWeight: 493.6824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)COCC(CS)N)C(=O)NC(CCSC)C(=O)NCC2=CC=CO2

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)COCC(CS)N)C(=O)NC(CCSC)C(=O)NCC2=CC=CO2

InChI

InChI=1S/C24H35N3O4S2/c1-16(2)20-7-6-17(13-30-14-18(25)15-32)11-21(20)23(28)27-22(8-10-33-3)24(29)26-12-19-5-4-9-31-19/h4-7,9,11,16,18,22,32H,8,10,12-15,25H2,1-3H3,(H,26,29)(H,27,28)