1-(4-chlorophenyl)-8-(4-methyl-3-nitro-phenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-2-one

Systemtic Name: 1-(4-chlorophenyl)-8-(4-methyl-3-nitro-phenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-2-one Openeye Name: 1-(4-chlorophenyl)-8-(4-methyl-3-nitro-benzoyl)-4-thia-1,8-diazaspiro[4.5]decan-2-one CAS Name: 1-(4-chlorophenyl)-8-[(4-methyl-3-nitrophenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-2-one IUPAC Name: 1-(4-chlorophenyl)-8-(4-methyl-3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-2-one Traditional Name: 1-(4-chlorophenyl)-8-(4-methyl-3-nitro-benzoyl)-4-thia-1,8-diazaspiro[4.5]decan-2-one Formula: C21H20ClN3O4S MolecularWeight: 445.9192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC3(CC2)N(C(=O)CS3)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC3(CC2)N(C(=O)CS3)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H20ClN3O4S/c1-14-2-3-15(12-18(14)25(28)29)20(27)23-10-8-21(9-11-23)24(19(26)13-30-21)17-6-4-16(22)5-7-17/h2-7,12H,8-11,13H2,1H3