3-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: 3-(2-benzoyl-4-chloro-anilino)-2-(4-phenylthiazol-2-yl)prop-2-enenitrile CAS Name: 3-(2-benzoyl-4-chloroanilino)-2-(4-phenyl-2-thiazolyl)-2-propenenitrile IUPAC Name: 3-(2-benzoyl-4-chloroanilino)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: 3-(2-benzoyl-4-chloro-anilino)-2-(4-phenylthiazol-2-yl)acrylonitrile Formula: C25H16ClN3OS MolecularWeight: 441.93204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H16ClN3OS/c26-20-11-12-22(21(13-20)24(30)18-9-5-2-6-10-18)28-15-19(14-27)25-29-23(16-31-25)17-7-3-1-4-8-17/h1-13,15-16,28H