6-chloranyl-3-[5-[(4-propoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]chromen-2-one

Systemtic Name: 6-chloranyl-3-[5-[(4-propoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]chromen-2-one Openeye Name: 6-chloro-3-[5-(4-propoxyanilino)-1,3,4-thiadiazol-2-yl]chromen-2-one CAS Name: 6-chloro-3-[5-(4-propoxyanilino)-1,3,4-thiadiazol-2-yl]-1-benzopyran-2-one IUPAC Name: 6-chloro-3-[5-(4-propoxyanilino)-1,3,4-thiadiazol-2-yl]chromen-2-one Traditional Name: 6-chloro-3-[5-(4-propoxyanilino)-1,3,4-thiadiazol-2-yl]coumarin Formula: C20H16ClN3O3S MolecularWeight: 413.87734

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)NC2=NN=C(S2)C3=CC4=C(C=CC(=C4)Cl)OC3=O

Isomeric SMILES

CCCOC1=CC=C(C=C1)NC2=NN=C(S2)C3=CC4=C(C=CC(=C4)Cl)OC3=O

InChI

InChI=1S/C20H16ClN3O3S/c1-2-9-26-15-6-4-14(5-7-15)22-20-24-23-18(28-20)16-11-12-10-13(21)3-8-17(12)27-19(16)25/h3-8,10-11H,2,9H2,1H3,(H,22,24)