(2-phenylazanyl-1,3-thiazol-4-yl)methyl 3-[(4-chlorophenyl)carbonylamino]propanoate

Systemtic Name: (2-phenylazanyl-1,3-thiazol-4-yl)methyl 3-[(4-chlorophenyl)carbonylamino]propanoate Openeye Name: (2-anilinothiazol-4-yl)methyl 3-[(4-chlorobenzoyl)amino]propanoate CAS Name: 3-[[(4-chlorophenyl)-oxomethyl]amino]propanoic acid (2-anilino-4-thiazolyl)methyl ester IUPAC Name: (2-anilino-1,3-thiazol-4-yl)methyl 3-[(4-chlorobenzoyl)amino]propanoate Traditional Name: 3-[(4-chlorobenzoyl)amino]propionic acid (2-anilinothiazol-4-yl)methyl ester Formula: C20H18ClN3O3S MolecularWeight: 415.89322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)CCNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)CCNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClN3O3S/c21-15-8-6-14(7-9-15)19(26)22-11-10-18(25)27-12-17-13-28-20(24-17)23-16-4-2-1-3-5-16/h1-9,13H,10-12H2,(H,22,26)(H,23,24)