2-(4-chlorophenyl)-6-ethoxy-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)chromen-4-imine

Systemtic Name: 2-(4-chlorophenyl)-6-ethoxy-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)chromen-4-imine Openeye Name: 2-(4-chlorophenyl)-6-ethoxy-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)chromen-4-imine CAS Name: 2-(4-chlorophenyl)-6-ethoxy-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1-benzopyran-4-imine IUPAC Name: 2-(4-chlorophenyl)-6-ethoxy-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)chromen-4-imine Traditional Name: (E)-[2-(4-chlorophenyl)-6-ethoxy-chromen-4-ylidene]-(5-isopropyl-1,3,4-thiadiazol-2-yl)amine Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=CC2=NC3=NN=C(S3)C(C)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=CC\2=C(C=C1)OC(=C/C2=N\C3=NN=C(S3)C(C)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClN3O2S/c1-4-27-16-9-10-19-17(11-16)18(24-22-26-25-21(29-22)13(2)3)12-20(28-19)14-5-7-15(23)8-6-14/h5-13H,4H2,1-3H3/b24-18+