4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(2-methyl-4-oxo-quinazolin-3-yl)benzamide CAS Name: 4-(2-methyl-4-oxo-3-quinazolinyl)-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-(2-methyl-4-oxoquinazolin-3-yl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-4-(4-keto-2-methyl-quinazolin-3-yl)benzamide Formula: C21H17N5O2S2 MolecularWeight: 435.52198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)NC4=NN=C(S4)SCC=C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)NC4=NN=C(S4)SCC=C

InChI

InChI=1S/C21H17N5O2S2/c1-3-12-29-21-25-24-20(30-21)23-18(27)14-8-10-15(11-9-14)26-13(2)22-17-7-5-4-6-16(17)19(26)28/h3-11H,1,12H2,2H3,(H,23,24,27)