S-[[cyclohexyl(prop-2-enyl)amino]methyl] 2-phenylethanethioate

Systemtic Name: S-[[cyclohexyl(prop-2-enyl)amino]methyl] 2-phenylethanethioate Openeye Name: S-[[allyl(cyclohexyl)amino]methyl] 2-phenylethanethioate CAS Name: 2-phenylethanethioic acid S-[[cyclohexyl(prop-2-enyl)amino]methyl] ester IUPAC Name: S-[[cyclohexyl(prop-2-enyl)amino]methyl] 2-phenylethanethioate Traditional Name: 2-phenylethanethioic acid S-[[allyl(cyclohexyl)amino]methyl] ester Formula: C18H25NOS MolecularWeight: 303.4622

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CSC(=O)CC1=CC=CC=C1)C2CCCCC2

Isomeric SMILES

C=CCN(CSC(=O)CC1=CC=CC=C1)C2CCCCC2

InChI

InChI=1S/C18H25NOS/c1-2-13-19(17-11-7-4-8-12-17)15-21-18(20)14-16-9-5-3-6-10-16/h2-3,5-6,9-10,17H,1,4,7-8,11-15H2