3-methyl-4-oxidanylidene-2-phenyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]chromene-8-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-2-phenyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]chromene-8-carboxamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-methyl-4-oxo-2-phenyl-chromene-8-carboxamide CAS Name: 3-methyl-4-oxo-2-phenyl-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-1-benzopyran-8-carboxamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-methyl-4-oxo-2-phenylchromene-8-carboxamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-4-keto-3-methyl-2-phenyl-chromene-8-carboxamide Formula: C26H19N3O3S2 MolecularWeight: 485.57736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H19N3O3S2/c1-16-21(30)19-13-8-14-20(23(19)32-22(16)18-11-6-3-7-12-18)24(31)27-25-28-29-26(34-25)33-15-17-9-4-2-5-10-17/h2-14H,15H2,1H3,(H,27,28,31)