3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)propanamide CAS Name: 3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-(2-keto-7-methoxy-4-methyl-chromen-3-yl)propionamide Formula: C23H21N3O4S2 MolecularWeight: 467.56054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

InChI

InChI=1S/C23H21N3O4S2/c1-14-17-9-8-16(29-2)12-19(17)30-21(28)18(14)10-11-20(27)24-22-25-26-23(32-22)31-13-15-6-4-3-5-7-15/h3-9,12H,10-11,13H2,1-2H3,(H,24,25,27)