N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C24H27N5O2S MolecularWeight: 449.56848

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)CCCN5C=NC6=CC=CC=C6C5=O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)CCCN5C=NC6=CC=CC=C6C5=O

InChI

InChI=1S/C24H27N5O2S/c30-20(6-3-7-29-14-25-19-5-2-1-4-18(19)21(29)31)26-23-28-27-22(32-23)24-11-15-8-16(12-24)10-17(9-15)13-24/h1-2,4-5,14-17H,3,6-13H2,(H,26,28,30)