[3-[(2-bromanyl-4-methyl-phenyl)carbamoylamino]-3-oxidanylidene-propyl] N,N-diethylcarbamodithioate

Systemtic Name: [3-[(2-bromanyl-4-methyl-phenyl)carbamoylamino]-3-oxidanylidene-propyl] N,N-diethylcarbamodithioate Openeye Name: [3-[(2-bromo-4-methyl-phenyl)carbamoylamino]-3-oxo-propyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [3-[[(2-bromo-4-methylanilino)-oxomethyl]amino]-3-oxopropyl] ester IUPAC Name: [3-[(2-bromo-4-methylphenyl)carbamoylamino]-3-oxopropyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [3-[(2-bromo-4-methyl-phenyl)carbamoylamino]-3-keto-propyl] ester Formula: C16H22BrN3O2S2 MolecularWeight: 432.39878

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCCC(=O)NC(=O)NC1=C(C=C(C=C1)C)Br

Isomeric SMILES

CCN(CC)C(=S)SCCC(=O)NC(=O)NC1=C(C=C(C=C1)C)Br

InChI

InChI=1S/C16H22BrN3O2S2/c1-4-20(5-2)16(23)24-9-8-14(21)19-15(22)18-13-7-6-11(3)10-12(13)17/h6-7,10H,4-5,8-9H2,1-3H3,(H2,18,19,21,22)