4-[[(5-nitro-1-benzothiophen-2-yl)carbonylamino]carbamoyl]-N,N-bis(prop-2-enyl)benzenesulfonamide

Systemtic Name: 4-[[(5-nitro-1-benzothiophen-2-yl)carbonylamino]carbamoyl]-N,N-bis(prop-2-enyl)benzenesulfonamide Openeye Name: N,N-diallyl-4-[[(5-nitrobenzothiophene-2-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: 4-[[[(5-nitro-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-oxomethyl]-N,N-bis(prop-2-enyl)benzenesulfonamide IUPAC Name: 4-[[(5-nitro-1-benzothiophene-2-carbonyl)amino]carbamoyl]-N,N-bis(prop-2-enyl)benzenesulfonamide Traditional Name: N,N-diallyl-4-[[(5-nitrobenzothiophene-2-carbonyl)amino]carbamoyl]benzenesulfonamide Formula: C22H20N4O6S2 MolecularWeight: 500.5474

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC=C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C=CCN(CC=C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O6S2/c1-3-11-25(12-4-2)34(31,32)18-8-5-15(6-9-18)21(27)23-24-22(28)20-14-16-13-17(26(29)30)7-10-19(16)33-20/h3-10,13-14H,1-2,11-12H2,(H,23,27)(H,24,28)