N-[1-(cyclohexylamino)-2-nitro-ethenyl]-4-(cyclooctylamino)pyridine-3-sulfonamide

Systemtic Name: N-[1-(cyclohexylamino)-2-nitro-ethenyl]-4-(cyclooctylamino)pyridine-3-sulfonamide Openeye Name: N-[1-(cyclohexylamino)-2-nitro-vinyl]-4-(cyclooctylamino)pyridine-3-sulfonamide CAS Name: N-[1-(cyclohexylamino)-2-nitroethenyl]-4-(cyclooctylamino)-3-pyridinesulfonamide IUPAC Name: N-[1-(cyclohexylamino)-2-nitroethenyl]-4-(cyclooctylamino)pyridine-3-sulfonamide Traditional Name: N-[1-(cyclohexylamino)-2-nitro-vinyl]-4-(cyclooctylamino)pyridine-3-sulfonamide Formula: C21H33N5O4S MolecularWeight: 451.58282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC2=C(C=NC=C2)S(=O)(=O)NC(=C[N+](=O)[O-])NC3CCCCC3

Isomeric SMILES

C1CCCC(CCC1)NC2=C(C=NC=C2)S(=O)(=O)NC(=C[N+](=O)[O-])NC3CCCCC3

InChI

InChI=1S/C21H33N5O4S/c27-26(28)16-21(24-18-11-7-4-8-12-18)25-31(29,30)20-15-22-14-13-19(20)23-17-9-5-2-1-3-6-10-17/h13-18,24-25H,1-12H2,(H,22,23)