[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-methylpiperazine-1-carbodithioate

Systemtic Name: [2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-methylpiperazine-1-carbodithioate Openeye Name: [2-(4-bromo-3-methyl-anilino)-2-oxo-ethyl] 4-methylpiperazine-1-carbodithioate CAS Name: 4-methyl-1-piperazinecarbodithioic acid [2-(4-bromo-3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-methylanilino)-2-oxoethyl] 4-methylpiperazine-1-carbodithioate Traditional Name: 4-methylpiperazine-1-carbodithioic acid [2-(4-bromo-3-methyl-anilino)-2-keto-ethyl] ester Formula: C15H20BrN3OS2 MolecularWeight: 402.3728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CSC(=S)N2CCN(CC2)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CSC(=S)N2CCN(CC2)C)Br

InChI

InChI=1S/C15H20BrN3OS2/c1-11-9-12(3-4-13(11)16)17-14(20)10-22-15(21)19-7-5-18(2)6-8-19/h3-4,9H,5-8,10H2,1-2H3,(H,17,20)