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

Systemtic Name: 2-[[4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-prop-2-enyl-amino]methyl]phenyl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[4-[[allyl-(5-methyl-4-phenyl-thiazol-2-yl)amino]methyl]benzoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[[4-[[(5-methyl-4-phenyl-2-thiazolyl)-prop-2-enylamino]methyl]phenyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-prop-2-enylamino]methyl]benzoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[4-[[allyl-(5-methyl-4-phenyl-thiazol-2-yl)amino]methyl]benzoyl]amino]-3-phenyl-propionic acid Formula: C30H29N3O3S MolecularWeight: 511.63456

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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)NC(CC3=CC=CC=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(S1)N(CC=C)CC2=CC=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C30H29N3O3S/c1-3-18-33(30-32-27(21(2)37-30)24-12-8-5-9-13-24)20-23-14-16-25(17-15-23)28(34)31-26(29(35)36)19-22-10-6-4-7-11-22/h3-17,26H,1,18-20H2,2H3,(H,31,34)(H,35,36)