[2-[[3,3-dimethyl-4-(2-methylprop-1-enyl)thietan-2-ylidene]amino]phenyl] ethanoate

Systemtic Name: [2-[[3,3-dimethyl-4-(2-methylprop-1-enyl)thietan-2-ylidene]amino]phenyl] ethanoate Openeye Name: [2-[[3,3-dimethyl-4-(2-methylprop-1-enyl)thietan-2-ylidene]amino]phenyl] acetate CAS Name: acetic acid [2-[[3,3-dimethyl-4-(2-methylprop-1-enyl)-2-thietanylidene]amino]phenyl] ester IUPAC Name: [2-[[3,3-dimethyl-4-(2-methylprop-1-enyl)thietan-2-ylidene]amino]phenyl] acetate Traditional Name: acetic acid [2-[[3,3-dimethyl-4-(2-methylprop-1-enyl)thietan-2-ylidene]amino]phenyl] ester Formula: C17H21NO2S MolecularWeight: 303.41914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1C(C(=NC2=CC=CC=C2OC(=O)C)S1)(C)C)C

Isomeric SMILES

CC(=CC1C(C(=NC2=CC=CC=C2OC(=O)C)S1)(C)C)C

InChI

InChI=1S/C17H21NO2S/c1-11(2)10-15-17(4,5)16(21-15)18-13-8-6-7-9-14(13)20-12(3)19/h6-10,15H,1-5H3