3-(2-chlorophenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(2-chlorophenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-(2-chlorophenyl)-2-[4-(3-nitrophenyl)thiazol-2-yl]-3-oxo-propanenitrile CAS Name: 3-(2-chlorophenyl)-2-[4-(3-nitrophenyl)-2-thiazolyl]-3-oxopropanenitrile IUPAC Name: 3-(2-chlorophenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxopropanenitrile Traditional Name: 3-(2-chlorophenyl)-3-keto-2-[4-(3-nitrophenyl)thiazol-2-yl]propionitrile Formula: C18H10ClN3O3S MolecularWeight: 383.8083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H10ClN3O3S/c19-15-7-2-1-6-13(15)17(23)14(9-20)18-21-16(10-26-18)11-4-3-5-12(8-11)22(24)25/h1-8,10,14H