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

Systemtic Name: 2-[[4-[[(4-naphthalen-2-yl-1,3-thiazol-2-yl)-prop-2-enyl-amino]methyl]phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-[[allyl-[4-(2-naphthyl)thiazol-2-yl]amino]methyl]benzoyl]amino]acetic acid CAS Name: 2-[[[4-[[[4-(2-naphthalenyl)-2-thiazolyl]-prop-2-enylamino]methyl]phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-[[(4-naphthalen-2-yl-1,3-thiazol-2-yl)-prop-2-enylamino]methyl]benzoyl]amino]acetic acid Traditional Name: 2-[[4-[[allyl-[4-(2-naphthyl)thiazol-2-yl]amino]methyl]benzoyl]amino]acetic acid Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=C(C=C1)C(=O)NCC(=O)O)C2=NC(=CS2)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C=CCN(CC1=CC=C(C=C1)C(=O)NCC(=O)O)C2=NC(=CS2)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H23N3O3S/c1-2-13-29(16-18-7-9-20(10-8-18)25(32)27-15-24(30)31)26-28-23(17-33-26)22-12-11-19-5-3-4-6-21(19)14-22/h2-12,14,17H,1,13,15-16H2,(H,27,32)(H,30,31)