2-(4a-methyl-1-oxidanyl-7-oxidanylidene-1,2,3,4-tetrahydronaphthalen-2-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 2-(4a-methyl-1-oxidanyl-7-oxidanylidene-1,2,3,4-tetrahydronaphthalen-2-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]-2-(1-hydroxy-4a-methyl-7-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide CAS Name: 2-(1-hydroxy-4a-methyl-7-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 2-(1-hydroxy-4a-methyl-7-oxo-1,2,3,4-tetrahydronaphthalen-2-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]-2-(1-hydroxy-7-keto-4a-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propionamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C(C)C2CCC3(C=CC(=O)C=C3C2O)C

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)C(C)C2CCC3(C=CC(=O)C=C3C2O)C

InChI

InChI=1S/C21H29N3O3S/c1-5-13(6-2)19-23-24-20(28-19)22-18(27)12(3)15-8-10-21(4)9-7-14(25)11-16(21)17(15)26/h7,9,11-13,15,17,26H,5-6,8,10H2,1-4H3,(H,22,24,27)