3-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 3-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide CAS Name: 3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-3-[(2S)-3-keto-2-methyl-1,4-benzoxazin-4-yl]propionamide Formula: C19H24N4O3S MolecularWeight: 388.48386

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)CCN2C3=CC=CC=C3OC(C2=O)C

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)CCN2C3=CC=CC=C3O[C@H](C2=O)C

InChI

InChI=1S/C19H24N4O3S/c1-4-13(5-2)17-21-22-19(27-17)20-16(24)10-11-23-14-8-6-7-9-15(14)26-12(3)18(23)25/h6-9,12-13H,4-5,10-11H2,1-3H3,(H,20,22,24)/t12-/m0/s1