7-[[5-[(4-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]methoxy]-4,8-dimethyl-chromen-2-one

Systemtic Name: 7-[[5-[(4-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]methoxy]-4,8-dimethyl-chromen-2-one Openeye Name: 7-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]methoxy]-4,8-dimethyl-chromen-2-one CAS Name: 7-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]methoxy]-4,8-dimethyl-1-benzopyran-2-one IUPAC Name: 7-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]methoxy]-4,8-dimethylchromen-2-one Traditional Name: 4,8-dimethyl-7-[[5-(p-anisidino)-1,3,4-thiadiazol-2-yl]methoxy]coumarin Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2C)OCC3=NN=C(S3)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2C)OCC3=NN=C(S3)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C21H19N3O4S/c1-12-10-19(25)28-20-13(2)17(9-8-16(12)20)27-11-18-23-24-21(29-18)22-14-4-6-15(26-3)7-5-14/h4-10H,11H2,1-3H3,(H,22,24)