propyl 2-[1-(4-iodophenyl)-4-(2-oxidanylidenechromen-3-yl)imidazol-2-yl]sulfanylethanoate

Systemtic Name: propyl 2-[1-(4-iodophenyl)-4-(2-oxidanylidenechromen-3-yl)imidazol-2-yl]sulfanylethanoate Openeye Name: propyl 2-[1-(4-iodophenyl)-4-(2-oxochromen-3-yl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(4-iodophenyl)-4-(2-oxo-1-benzopyran-3-yl)-2-imidazolyl]thio]acetic acid propyl ester IUPAC Name: propyl 2-[1-(4-iodophenyl)-4-(2-oxochromen-3-yl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(4-iodophenyl)-4-(2-ketochromen-3-yl)imidazol-2-yl]thio]acetic acid propyl ester Formula: C23H19IN2O4S MolecularWeight: 546.37743

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CSC1=NC(=CN1C2=CC=C(C=C2)I)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CCCOC(=O)CSC1=NC(=CN1C2=CC=C(C=C2)I)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C23H19IN2O4S/c1-2-11-29-21(27)14-31-23-25-19(13-26(23)17-9-7-16(24)8-10-17)18-12-15-5-3-4-6-20(15)30-22(18)28/h3-10,12-13H,2,11,14H2,1H3