butyl 4-[2-[3-[[(Z)-2-benzamido-3-phenyl-prop-2-enoyl]amino]phenyl]sulfanylethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[3-[[(Z)-2-benzamido-3-phenyl-prop-2-enoyl]amino]phenyl]sulfanylethanoylamino]benzoate Openeye Name: butyl 4-[[2-[3-[[(Z)-2-benzamido-3-phenyl-prop-2-enoyl]amino]phenyl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[3-[[(Z)-2-benzamido-1-oxo-3-phenylprop-2-enyl]amino]phenyl]thio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[3-[[(Z)-2-benzamido-3-phenylprop-2-enoyl]amino]phenyl]sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[[3-[[(Z)-2-benzamido-3-phenyl-acryloyl]amino]phenyl]thio]acetyl]amino]benzoic acid butyl ester Formula: C35H33N3O5S MolecularWeight: 607.71862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)C(=CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)/C(=C/C3=CC=CC=C3)/NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C35H33N3O5S/c1-2-3-21-43-35(42)27-17-19-28(20-18-27)36-32(39)24-44-30-16-10-15-29(23-30)37-34(41)31(22-25-11-6-4-7-12-25)38-33(40)26-13-8-5-9-14-26/h4-20,22-23H,2-3,21,24H2,1H3,(H,36,39)(H,37,41)(H,38,40)/b31-22-