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

Systemtic Name: 3-[5-[(4-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]chromen-2-one Openeye Name: 3-[5-(4-methylanilino)-1,3,4-thiadiazol-2-yl]chromen-2-one CAS Name: 3-[5-(4-methylanilino)-1,3,4-thiadiazol-2-yl]-1-benzopyran-2-one IUPAC Name: 3-[5-(4-methylanilino)-1,3,4-thiadiazol-2-yl]chromen-2-one Traditional Name: 3-[5-(p-toluidino)-1,3,4-thiadiazol-2-yl]coumarin Formula: C18H13N3O2S MolecularWeight: 335.37972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NN=C(S2)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NN=C(S2)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C18H13N3O2S/c1-11-6-8-13(9-7-11)19-18-21-20-16(24-18)14-10-12-4-2-3-5-15(12)23-17(14)22/h2-10H,1H3,(H,19,21)