7-(diethylamino)-3-[5-[(4-phenoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]chromen-2-one

Systemtic Name: 7-(diethylamino)-3-[5-[(4-phenoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]chromen-2-one Openeye Name: 7-(diethylamino)-3-[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]chromen-2-one CAS Name: 7-(diethylamino)-3-[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]-1-benzopyran-2-one IUPAC Name: 7-(diethylamino)-3-[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]chromen-2-one Traditional Name: 7-(diethylamino)-3-[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]coumarin Formula: C27H24N4O3S MolecularWeight: 484.56946

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NN=C(S3)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NN=C(S3)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C27H24N4O3S/c1-3-31(4-2)20-13-10-18-16-23(26(32)34-24(18)17-20)25-29-30-27(35-25)28-19-11-14-22(15-12-19)33-21-8-6-5-7-9-21/h5-17H,3-4H2,1-2H3,(H,28,30)