2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-oxidanylidenechromen-6-yl)amino]propanenitrile

Systemtic Name: 2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-oxidanylidenechromen-6-yl)amino]propanenitrile Openeye Name: 2-[4-(4-ethoxyphenyl)thiazol-2-yl]-3-[(2-oxochromen-6-yl)amino]propanenitrile CAS Name: 2-[4-(4-ethoxyphenyl)-2-thiazolyl]-3-[(2-oxo-1-benzopyran-6-yl)amino]propanenitrile IUPAC Name: 2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-oxochromen-6-yl)amino]propanenitrile Traditional Name: 3-[(2-ketochromen-6-yl)amino]-2-(4-p-phenetylthiazol-2-yl)propionitrile Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=N2)C(CNC3=CC4=C(C=C3)OC(=O)C=C4)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=N2)C(CNC3=CC4=C(C=C3)OC(=O)C=C4)C#N

InChI

InChI=1S/C23H19N3O3S/c1-2-28-19-7-3-15(4-8-19)20-14-30-23(26-20)17(12-24)13-25-18-6-9-21-16(11-18)5-10-22(27)29-21/h3-11,14,17,25H,2,13H2,1H3