methyl 2-[2-[4-[[(Z)-2-benzamido-3-(2-methoxyphenyl)prop-2-enoyl]amino]phenyl]sulfanylpropanoylamino]benzoate

Systemtic Name: methyl 2-[2-[4-[[(Z)-2-benzamido-3-(2-methoxyphenyl)prop-2-enoyl]amino]phenyl]sulfanylpropanoylamino]benzoate Openeye Name: methyl 2-[2-[4-[[(Z)-2-benzamido-3-(2-methoxyphenyl)prop-2-enoyl]amino]phenyl]sulfanylpropanoylamino]benzoate CAS Name: 2-[[2-[[4-[[(Z)-2-benzamido-3-(2-methoxyphenyl)-1-oxoprop-2-enyl]amino]phenyl]thio]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[2-[4-[[(Z)-2-benzamido-3-(2-methoxyphenyl)prop-2-enoyl]amino]phenyl]sulfanylpropanoylamino]benzoate Traditional Name: 2-[2-[[4-[[(Z)-2-benzamido-3-(2-methoxyphenyl)acryloyl]amino]phenyl]thio]propanoylamino]benzoic acid methyl ester Formula: C34H31N3O6S MolecularWeight: 609.69144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=O)OC)SC2=CC=C(C=C2)NC(=O)C(=CC3=CC=CC=C3OC)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C(=O)OC)SC2=CC=C(C=C2)NC(=O)/C(=C/C3=CC=CC=C3OC)/NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C34H31N3O6S/c1-22(31(38)36-28-15-9-8-14-27(28)34(41)43-3)44-26-19-17-25(18-20-26)35-33(40)29(21-24-13-7-10-16-30(24)42-2)37-32(39)23-11-5-4-6-12-23/h4-22H,1-3H3,(H,35,40)(H,36,38)(H,37,39)/b29-21-