methyl 2-[(4-methoxyphenyl)sulfonyl-[[2-(3-phenylpropanoylamino)phenyl]methyl]amino]prop-2-enoate

Systemtic Name: methyl 2-[(4-methoxyphenyl)sulfonyl-[[2-(3-phenylpropanoylamino)phenyl]methyl]amino]prop-2-enoate Openeye Name: methyl 2-[(4-methoxyphenyl)sulfonyl-[[2-(3-phenylpropanoylamino)phenyl]methyl]amino]prop-2-enoate CAS Name: 2-[(4-methoxyphenyl)sulfonyl-[[2-[(1-oxo-3-phenylpropyl)amino]phenyl]methyl]amino]-2-propenoic acid methyl ester IUPAC Name: methyl 2-[(4-methoxyphenyl)sulfonyl-[[2-(3-phenylpropanoylamino)phenyl]methyl]amino]prop-2-enoate Traditional Name: 2-[[2-(hydrocinnamoylamino)benzyl]-(4-methoxyphenyl)sulfonyl-amino]acrylic acid methyl ester Formula: C27H28N2O6S MolecularWeight: 508.58602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2NC(=O)CCC3=CC=CC=C3)C(=C)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2NC(=O)CCC3=CC=CC=C3)C(=C)C(=O)OC

InChI

InChI=1S/C27H28N2O6S/c1-20(27(31)35-3)29(36(32,33)24-16-14-23(34-2)15-17-24)19-22-11-7-8-12-25(22)28-26(30)18-13-21-9-5-4-6-10-21/h4-12,14-17H,1,13,18-19H2,2-3H3,(H,28,30)