(4-nitrophenyl)methyl N-(3,4-dimethylphenyl)carbamodithioate

Systemtic Name: (4-nitrophenyl)methyl N-(3,4-dimethylphenyl)carbamodithioate Openeye Name: (4-nitrophenyl)methyl N-(3,4-dimethylphenyl)carbamodithioate CAS Name: N-(3,4-dimethylphenyl)carbamodithioic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-(3,4-dimethylphenyl)carbamodithioate Traditional Name: N-(3,4-dimethylphenyl)carbamodithioic acid (4-nitrobenzyl) ester Formula: C16H16N2O2S2 MolecularWeight: 332.44044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)SCC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)SCC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H16N2O2S2/c1-11-3-6-14(9-12(11)2)17-16(21)22-10-13-4-7-15(8-5-13)18(19)20/h3-9H,10H2,1-2H3,(H,17,21)