N-methyl-3-(4-oxidanylidenequinazolin-3-yl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: N-methyl-3-(4-oxidanylidenequinazolin-3-yl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-N-methyl-3-(4-oxoquinazolin-3-yl)propanamide CAS Name: N-methyl-3-(4-oxo-3-quinazolinyl)-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-N-methyl-3-(4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-(4-ketoquinazolin-3-yl)-N-methyl-propionamide Formula: C21H19N5O2S2 MolecularWeight: 437.53786

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NN=C(S1)SCC2=CC=CC=C2)C(=O)CCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CN(C1=NN=C(S1)SCC2=CC=CC=C2)C(=O)CCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19N5O2S2/c1-25(20-23-24-21(30-20)29-13-15-7-3-2-4-8-15)18(27)11-12-26-14-22-17-10-6-5-9-16(17)19(26)28/h2-10,14H,11-13H2,1H3