(E)-1-(2-chlorophenyl)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenolate; pyrrolidin-1-ium

Systemtic Name: (E)-1-(2-chlorophenyl)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenolate; pyrrolidin-1-ium Openeye Name: (E)-1-(2-chlorophenyl)-2-cyano-2-(4-phenylthiazol-2-yl)ethenolate; pyrrolidin-1-ium CAS Name: (E)-1-(2-chlorophenyl)-2-cyano-2-(4-phenyl-2-thiazolyl)ethenolate; pyrrolidin-1-ium IUPAC Name: (E)-1-(2-chlorophenyl)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenolate; pyrrolidin-1-ium Traditional Name: (E)-1-(2-chlorophenyl)-2-cyano-2-(4-phenylthiazol-2-yl)ethenolate; pyrrolidin-1-ium Formula: C22H20ClN3OS MolecularWeight: 409.9317

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH2+]C1.C1=CC=C(C=C1)C2=CSC(=N2)C(=C(C3=CC=CC=C3Cl)[O-])C#N

Isomeric SMILES

C1CC[NH2+]C1.C1=CC=C(C=C1)C2=CSC(=N2)/C(=C(\C3=CC=CC=C3Cl)/[O-])/C#N

InChI

InChI=1S/C18H11ClN2OS.C4H9N/c19-15-9-5-4-8-13(15)17(22)14(10-20)18-21-16(11-23-18)12-6-2-1-3-7-12;1-2-4-5-3-1/h1-9,11,22H;5H,1-4H2/b17-14+;