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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=C[N+](=O)[O-])NS(=O)(=O)C2=C(C=CN=C2)NC3CCCCC3

Isomeric SMILES

C1CCCC(CCC1)N/C(=C\[N+](=O)[O-])/NS(=O)(=O)C2=C(C=CN=C2)NC3CCCCC3

InChI

InChI=1S/C21H33N5O4S/c27-26(28)16-21(24-18-11-5-2-1-3-6-12-18)25-31(29,30)20-15-22-14-13-19(20)23-17-9-7-4-8-10-17/h13-18,24-25H,1-12H2,(H,22,23)/b21-16+