S-[2-[[6-[(4-chlorophenyl)amino]-6-oxidanylidene-hexyl]amino]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[[6-[(4-chlorophenyl)amino]-6-oxidanylidene-hexyl]amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[[6-(4-chloroanilino)-6-oxo-hexyl]amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[[6-(4-chloroanilino)-6-oxohexyl]amino]-2-oxoethyl] ester IUPAC Name: S-[2-[[6-(4-chloroanilino)-6-oxohexyl]amino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[[6-(4-chloroanilino)-6-keto-hexyl]amino]-2-keto-ethyl] ester Formula: C16H21ClN2O3S MolecularWeight: 356.86754

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)NCCCCCC(=O)NC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(=O)SCC(=O)NCCCCCC(=O)NC1=CC=C(C=C1)Cl

InChI

InChI=1S/C16H21ClN2O3S/c1-12(20)23-11-16(22)18-10-4-2-3-5-15(21)19-14-8-6-13(17)7-9-14/h6-9H,2-5,10-11H2,1H3,(H,18,22)(H,19,21)