2-[[4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-prop-2-enyl-amino]methyl]phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-prop-2-enyl-amino]methyl]phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-[[allyl-(5-methyl-4-phenyl-thiazol-2-yl)amino]methyl]benzoyl]amino]acetic acid CAS Name: 2-[[[4-[[(5-methyl-4-phenyl-2-thiazolyl)-prop-2-enylamino]methyl]phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-prop-2-enylamino]methyl]benzoyl]amino]acetic acid Traditional Name: 2-[[4-[[allyl-(5-methyl-4-phenyl-thiazol-2-yl)amino]methyl]benzoyl]amino]acetic acid Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)N(CC=C)CC2=CC=C(C=C2)C(=O)NCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(N=C(S1)N(CC=C)CC2=CC=C(C=C2)C(=O)NCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C23H23N3O3S/c1-3-13-26(23-25-21(16(2)30-23)18-7-5-4-6-8-18)15-17-9-11-19(12-10-17)22(29)24-14-20(27)28/h3-12H,1,13-15H2,2H3,(H,24,29)(H,27,28)