[2-[(2-chlorophenyl)sulfonylcarbamoylamino]-6-methyl-pyrimidin-4-yl] N-phenylcarbamodithioate

Systemtic Name: [2-[(2-chlorophenyl)sulfonylcarbamoylamino]-6-methyl-pyrimidin-4-yl] N-phenylcarbamodithioate Openeye Name: [2-[(2-chlorophenyl)sulfonylcarbamoylamino]-6-methyl-pyrimidin-4-yl] N-phenylcarbamodithioate CAS Name: N-phenylcarbamodithioic acid [2-[[[(2-chlorophenyl)sulfonylamino]-oxomethyl]amino]-6-methyl-4-pyrimidinyl] ester IUPAC Name: [2-[(2-chlorophenyl)sulfonylcarbamoylamino]-6-methylpyrimidin-4-yl] N-phenylcarbamodithioate Traditional Name: N-phenylcarbamodithioic acid [2-[(2-chlorophenyl)sulfonylcarbamoylamino]-6-methyl-pyrimidin-4-yl] ester Formula: C19H16ClN5O3S3 MolecularWeight: 494.01004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2Cl)SC(=S)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2Cl)SC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C19H16ClN5O3S3/c1-12-11-16(30-19(29)22-13-7-3-2-4-8-13)23-17(21-12)24-18(26)25-31(27,28)15-10-6-5-9-14(15)20/h2-11H,1H3,(H,22,29)(H2,21,23,24,25,26)