1-[2-(cyclohexylamino)-5-nitro-phenyl]sulfonyl-3-propan-2-yl-thiourea

Systemtic Name: 1-[2-(cyclohexylamino)-5-nitro-phenyl]sulfonyl-3-propan-2-yl-thiourea Openeye Name: 1-[2-(cyclohexylamino)-5-nitro-phenyl]sulfonyl-3-isopropyl-thiourea CAS Name: 1-[2-(cyclohexylamino)-5-nitrophenyl]sulfonyl-3-propan-2-ylthiourea IUPAC Name: 1-[2-(cyclohexylamino)-5-nitrophenyl]sulfonyl-3-propan-2-ylthiourea Traditional Name: 1-[2-(cyclohexylamino)-5-nitro-phenyl]sulfonyl-3-isopropyl-thiourea Formula: C16H24N4O4S2 MolecularWeight: 400.51616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCCC2

Isomeric SMILES

CC(C)NC(=S)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCCC2

InChI

InChI=1S/C16H24N4O4S2/c1-11(2)17-16(25)19-26(23,24)15-10-13(20(21)22)8-9-14(15)18-12-6-4-3-5-7-12/h8-12,18H,3-7H2,1-2H3,(H2,17,19,25)