propyl 4-[[(E)-2-cyano-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)ethenyl]amino]benzoate

Systemtic Name: propyl 4-[[(E)-2-cyano-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)ethenyl]amino]benzoate Openeye Name: propyl 4-[[(E)-2-cyano-2-[4-(2-thienyl)thiazol-2-yl]vinyl]amino]benzoate CAS Name: 4-[[(E)-2-cyano-2-(4-thiophen-2-yl-2-thiazolyl)ethenyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[(E)-2-cyano-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)ethenyl]amino]benzoate Traditional Name: 4-[[(E)-2-cyano-2-[4-(2-thienyl)thiazol-2-yl]vinyl]amino]benzoic acid propyl ester Formula: C20H17N3O2S2 MolecularWeight: 395.49788

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC=CS3

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)N/C=C(\C#N)/C2=NC(=CS2)C3=CC=CS3

InChI

InChI=1S/C20H17N3O2S2/c1-2-9-25-20(24)14-5-7-16(8-6-14)22-12-15(11-21)19-23-17(13-27-19)18-4-3-10-26-18/h3-8,10,12-13,22H,2,9H2,1H3/b15-12+