1-[2-(cycloheptylamino)-5-nitro-phenyl]sulfonyl-3-ethyl-thiourea

Systemtic Name: 1-[2-(cycloheptylamino)-5-nitro-phenyl]sulfonyl-3-ethyl-thiourea Openeye Name: 1-[2-(cycloheptylamino)-5-nitro-phenyl]sulfonyl-3-ethyl-thiourea CAS Name: 1-[2-(cycloheptylamino)-5-nitrophenyl]sulfonyl-3-ethylthiourea IUPAC Name: 1-[2-(cycloheptylamino)-5-nitrophenyl]sulfonyl-3-ethylthiourea Traditional Name: 1-[2-(cycloheptylamino)-5-nitro-phenyl]sulfonyl-3-ethyl-thiourea Formula: C16H24N4O4S2 MolecularWeight: 400.51616

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCCCC2

Isomeric SMILES

CCNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCCCC2

InChI

InChI=1S/C16H24N4O4S2/c1-2-17-16(25)19-26(23,24)15-11-13(20(21)22)9-10-14(15)18-12-7-5-3-4-6-8-12/h9-12,18H,2-8H2,1H3,(H2,17,19,25)