methyl 4-methyl-3-[[(E)-3-phenylsulfanylprop-2-enoyl]amino]benzoate

Systemtic Name: methyl 4-methyl-3-[[(E)-3-phenylsulfanylprop-2-enoyl]amino]benzoate Openeye Name: methyl 4-methyl-3-[[(E)-3-phenylsulfanylprop-2-enoyl]amino]benzoate CAS Name: 4-methyl-3-[[(E)-1-oxo-3-(phenylthio)prop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[(E)-3-phenylsulfanylprop-2-enoyl]amino]benzoate Traditional Name: 4-methyl-3-[[(E)-3-(phenylthio)acryloyl]amino]benzoic acid methyl ester Formula: C18H17NO3S MolecularWeight: 327.39748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C=CSC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)/C=C/SC2=CC=CC=C2

InChI

InChI=1S/C18H17NO3S/c1-13-8-9-14(18(21)22-2)12-16(13)19-17(20)10-11-23-15-6-4-3-5-7-15/h3-12H,1-2H3,(H,19,20)/b11-10+