N-[5-[(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)carbamoyl]-2,3,5-tris(oxidanyl)cyclohexyl]-2-methoxy-4-methylsulfanyl-benzamide

Systemtic Name: N-[5-[(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)carbamoyl]-2,3,5-tris(oxidanyl)cyclohexyl]-2-methoxy-4-methylsulfanyl-benzamide Openeye Name: N-[5-[(1-carbamoyl-3-methyl-butyl)carbamoyl]-2,3,5-trihydroxy-cyclohexyl]-2-methoxy-4-methylsulfanyl-benzamide CAS Name: N-[5-[[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-oxomethyl]-2,3,5-trihydroxycyclohexyl]-2-methoxy-4-(methylthio)benzamide IUPAC Name: N-[5-[(1-amino-4-methyl-1-oxopentan-2-yl)carbamoyl]-2,3,5-trihydroxycyclohexyl]-2-methoxy-4-methylsulfanylbenzamide Traditional Name: N-[5-[(1-carbamoyl-3-methyl-butyl)carbamoyl]-2,3,5-trihydroxy-cyclohexyl]-2-methoxy-4-(methylthio)benzamide Formula: C22H33N3O7S MolecularWeight: 483.57832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NC(=O)C1(CC(C(C(C1)O)O)NC(=O)C2=C(C=C(C=C2)SC)OC)O

Isomeric SMILES

CC(C)CC(C(=O)N)NC(=O)C1(CC(C(C(C1)O)O)NC(=O)C2=C(C=C(C=C2)SC)OC)O

InChI

InChI=1S/C22H33N3O7S/c1-11(2)7-14(19(23)28)25-21(30)22(31)9-15(18(27)16(26)10-22)24-20(29)13-6-5-12(33-4)8-17(13)32-3/h5-6,8,11,14-16,18,26-27,31H,7,9-10H2,1-4H3,(H2,23,28)(H,24,29)(H,25,30)