1-(2-methylpropanoyl)-N-(4-nitrophenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide

Systemtic Name: 1-(2-methylpropanoyl)-N-(4-nitrophenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: 1-(2-methylpropanoyl)-N-(4-nitrophenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: 1-(2-methyl-1-oxopropyl)-N-(4-nitrophenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: 1-(2-methylpropanoyl)-N-(4-nitrophenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: 1-isobutyryl-N-(4-nitrophenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCSC12CCN(CC2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)N1CCSC12CCN(CC2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H24N4O4S/c1-13(2)16(23)21-11-12-27-18(21)7-9-20(10-8-18)17(24)19-14-3-5-15(6-4-14)22(25)26/h3-6,13H,7-12H2,1-2H3,(H,19,24)