(2-phenyl-1,3-thiazol-4-yl)methyl 4-[5-azanyl-4-(1,3-benzothiazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]benzoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-[5-azanyl-4-(1,3-benzothiazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]benzoate Openeye Name: (2-phenylthiazol-4-yl)methyl 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoate CAS Name: 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoate Traditional Name: 4-[2-amino-3-(1,3-benzothiazol-2-yl)-4-keto-2-pyrrolin-1-yl]benzoic acid (2-phenylthiazol-4-yl)methyl ester Formula: C28H20N4O3S2 MolecularWeight: 524.6134

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(N1C2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4)N)C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1C(=O)C(=C(N1C2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4)N)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C28H20N4O3S2/c29-25-24(27-31-21-8-4-5-9-23(21)37-27)22(33)14-32(25)20-12-10-18(11-13-20)28(34)35-15-19-16-36-26(30-19)17-6-2-1-3-7-17/h1-13,16H,14-15,29H2