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

Systemtic Name: S-[2-oxidanylidene-2-[(6-oxidanylidene-6-phenylazanyl-hexyl)amino]ethyl] ethanethioate Openeye Name: S-[2-[(6-anilino-6-oxo-hexyl)amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[(6-anilino-6-oxohexyl)amino]-2-oxoethyl] ester IUPAC Name: S-[2-[(6-anilino-6-oxohexyl)amino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[(6-anilino-6-keto-hexyl)amino]-2-keto-ethyl] ester Formula: C16H22N2O3S MolecularWeight: 322.42248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O3S/c1-13(19)22-12-16(21)17-11-7-3-6-10-15(20)18-14-8-4-2-5-9-14/h2,4-5,8-9H,3,6-7,10-12H2,1H3,(H,17,21)(H,18,20)