S-ethyl 3-cyclohexyl-3-phenylazanyl-propanethioate

Systemtic Name: S-ethyl 3-cyclohexyl-3-phenylazanyl-propanethioate Openeye Name: S-ethyl 3-anilino-3-cyclohexyl-propanethioate CAS Name: 3-anilino-3-cyclohexylpropanethioic acid S-ethyl ester IUPAC Name: S-ethyl 3-anilino-3-cyclohexylpropanethioate Traditional Name: 3-anilino-3-cyclohexyl-propanethioic acid S-ethyl ester Formula: C17H25NOS MolecularWeight: 291.4515

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)CC(C1CCCCC1)NC2=CC=CC=C2

Isomeric SMILES

CCSC(=O)CC(C1CCCCC1)NC2=CC=CC=C2

InChI

InChI=1S/C17H25NOS/c1-2-20-17(19)13-16(14-9-5-3-6-10-14)18-15-11-7-4-8-12-15/h4,7-8,11-12,14,16,18H,2-3,5-6,9-10,13H2,1H3