2-[[(E)-1-(2,3-dimethylphenyl)hex-4-enyl]carbamothioylamino]ethyl ethanoate

Systemtic Name: 2-[[(E)-1-(2,3-dimethylphenyl)hex-4-enyl]carbamothioylamino]ethyl ethanoate Openeye Name: 2-[[(E)-1-(2,3-dimethylphenyl)hex-4-enyl]carbamothioylamino]ethyl acetate CAS Name: acetic acid 2-[[[[(E)-1-(2,3-dimethylphenyl)hex-4-enyl]amino]-sulfanylidenemethyl]amino]ethyl ester IUPAC Name: 2-[[(E)-1-(2,3-dimethylphenyl)hex-4-enyl]carbamothioylamino]ethyl acetate Traditional Name: acetic acid 2-[[(E)-1-(2,3-dimethylphenyl)hex-4-enyl]thiocarbamoylamino]ethyl ester Formula: C19H28N2O2S MolecularWeight: 348.50282

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCCC(C1=CC=CC(=C1C)C)NC(=S)NCCOC(=O)C

Isomeric SMILES

C/C=C/CCC(C1=CC=CC(=C1C)C)NC(=S)NCCOC(=O)C

InChI

InChI=1S/C19H28N2O2S/c1-5-6-7-11-18(17-10-8-9-14(2)15(17)3)21-19(24)20-12-13-23-16(4)22/h5-6,8-10,18H,7,11-13H2,1-4H3,(H2,20,21,24)/b6-5+