N-(2-methylbutyl)-8-(4-methyl-3-nitro-phenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide

Systemtic Name: N-(2-methylbutyl)-8-(4-methyl-3-nitro-phenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: N-(2-methylbutyl)-8-(4-methyl-3-nitro-benzoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: N-(2-methylbutyl)-8-[(4-methyl-3-nitrophenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: N-(2-methylbutyl)-8-(4-methyl-3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: N-(2-methylbutyl)-8-(4-methyl-3-nitro-benzoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C21H30N4O4S MolecularWeight: 434.5523

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC(=O)C1CSC2(N1)CCN(CC2)C(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCC(C)CNC(=O)C1CSC2(N1)CCN(CC2)C(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H30N4O4S/c1-4-14(2)12-22-19(26)17-13-30-21(23-17)7-9-24(10-8-21)20(27)16-6-5-15(3)18(11-16)25(28)29/h5-6,11,14,17,23H,4,7-10,12-13H2,1-3H3,(H,22,26)