3-[2-[(3-chlorophenyl)amino]-1,3-thiazol-4-yl]-7-(diethylamino)chromen-2-one

Systemtic Name: 3-[2-[(3-chlorophenyl)amino]-1,3-thiazol-4-yl]-7-(diethylamino)chromen-2-one Openeye Name: 3-[2-(3-chloroanilino)thiazol-4-yl]-7-(diethylamino)chromen-2-one CAS Name: 3-[2-(3-chloroanilino)-4-thiazolyl]-7-(diethylamino)-1-benzopyran-2-one IUPAC Name: 3-[2-(3-chloroanilino)-1,3-thiazol-4-yl]-7-(diethylamino)chromen-2-one Traditional Name: 3-[2-(3-chloroanilino)thiazol-4-yl]-7-(diethylamino)coumarin Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=CSC(=N3)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=CSC(=N3)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H20ClN3O2S/c1-3-26(4-2)17-9-8-14-10-18(21(27)28-20(14)12-17)19-13-29-22(25-19)24-16-7-5-6-15(23)11-16/h5-13H,3-4H2,1-2H3,(H,24,25)