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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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