N-[1-[2-(5-ethyl-4-methyl-thiophen-2-yl)carbonylhydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[1-[2-(5-ethyl-4-methyl-thiophen-2-yl)carbonylhydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[1-[[(5-ethyl-4-methyl-thiophene-2-carbonyl)amino]carbamoyl]-2-methyl-propyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[1-[[(5-ethyl-4-methyl-2-thiophenyl)-oxomethyl]hydrazo]-3-methyl-1-oxobutan-2-yl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[1-[2-(5-ethyl-4-methylthiophene-2-carbonyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[1-[[(5-ethyl-4-methyl-thiophene-2-carbonyl)amino]carbamoyl]-2-methyl-propyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C21H27N3O6S2 MolecularWeight: 481.58558

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C(=O)NNC(=O)C(C(C)C)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3)C

Isomeric SMILES

CCC1=C(C=C(S1)C(=O)NNC(=O)C(C(C)C)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3)C

InChI

InChI=1S/C21H27N3O6S2/c1-5-17-13(4)10-18(31-17)20(25)22-23-21(26)19(12(2)3)24-32(27,28)14-6-7-15-16(11-14)30-9-8-29-15/h6-7,10-12,19,24H,5,8-9H2,1-4H3,(H,22,25)(H,23,26)