[(4-methylphenyl)sulfonyl-(1-nitronaphthalen-2-yl)methyl] N,N-diethylcarbamodithioate

Systemtic Name: [(4-methylphenyl)sulfonyl-(1-nitronaphthalen-2-yl)methyl] N,N-diethylcarbamodithioate Openeye Name: [(1-nitro-2-naphthyl)-(p-tolylsulfonyl)methyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [(4-methylphenyl)sulfonyl-(1-nitro-2-naphthalenyl)methyl] ester IUPAC Name: [(4-methylphenyl)sulfonyl-(1-nitronaphthalen-2-yl)methyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [(1-nitro-2-naphthyl)-tosyl-methyl] ester Formula: C23H24N2O4S3 MolecularWeight: 488.64266

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SC(C1=C(C2=CC=CC=C2C=C1)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCN(CC)C(=S)SC(C1=C(C2=CC=CC=C2C=C1)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H24N2O4S3/c1-4-24(5-2)23(30)31-22(32(28,29)18-13-10-16(3)11-14-18)20-15-12-17-8-6-7-9-19(17)21(20)25(26)27/h6-15,22H,4-5H2,1-3H3